Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C35H34ClN7O4S2.ClH |
| Molecular Weight | 752.733 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.C[C@H](N)C(=O)N[C@@H](C)C(=O)OCCOC1=CC=C(C=C1)C2=C(C#N)C(SCC3=CSC(=N3)C4=CC=C(Cl)C=C4)=NC(N5CCCC5)=C2C#N
InChI
InChIKey=CZZKREIGVLUWPU-VROPFNGYSA-N
InChI=1S/C35H34ClN7O4S2.ClH/c1-21(39)32(44)40-22(2)35(45)47-16-15-46-27-11-7-23(8-12-27)30-28(17-37)31(43-13-3-4-14-43)42-34(29(30)18-38)49-20-26-19-48-33(41-26)24-5-9-25(36)10-6-24;/h5-12,19,21-22H,3-4,13-16,20,39H2,1-2H3,(H,40,44);1H/t21-,22-;/m0./s1
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C35H34ClN7O4S2 |
| Molecular Weight | 716.272 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 07:42:58 UTC 2023
by
admin
on
Sat Dec 16 07:42:58 UTC 2023
|
| Record UNII |
4059R4E33X
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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4059R4E33X
Created by
admin on Sat Dec 16 07:42:58 UTC 2023 , Edited by admin on Sat Dec 16 07:42:58 UTC 2023
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56848984
Created by
admin on Sat Dec 16 07:42:58 UTC 2023 , Edited by admin on Sat Dec 16 07:42:58 UTC 2023
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1239235-25-6
Created by
admin on Sat Dec 16 07:42:58 UTC 2023 , Edited by admin on Sat Dec 16 07:42:58 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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