VELUSETRAG

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H36N4O5S
Molecular Weight	504.642
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)N1C(=O)C(=CC2=CC=CC=C12)C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C[C@@H](O)CN(C)S(C)(=O)=O

InChI

InChIKey=HXLOHDZQBKCUCR-WOZUAGRISA-N

InChI=1S/C25H36N4O5S/c1-16(2)29-23-8-6-5-7-17(23)11-22(25(29)32)24(31)26-18-12-19-9-10-20(13-18)28(19)15-21(30)14-27(3)35(4,33)34/h5-8,11,16,18-21,30H,9-10,12-15H2,1-4H3,(H,26,31)/t18-,19+,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H36N4O5S
Molecular Weight	504.642
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:05:13 UTC 2023` Edited by `admin` on `Fri Dec 15 16:05:13 UTC 2023`
Record UNII	J4VNV64ARB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VELUSETRAG

Official Name

English

3-QUINOLINECARBOXAMIDE, 1,2-DIHYDRO-N-((3-ENDO)-8-((2R)-2-HYDROXY-3-(METHYL(METHYLSULFONYL)AMINO)PROPYL)-8-AZABICYCLO(3.2.1)OCT-3-YL)-1-(1-METHYLETHYL)-2-OXO-

Common Name

English

TD-5108

Code

English

velusetrag [INN]

Common Name

English

VELUSETRAG [USAN]

Common Name

English

Velusetrag [WHO-DD]

Common Name

English

N-((1R,3R,5S)-8-((2R)-2-HYDROXY-3-(METHYL(METHYLSULFONYL)AMINO)PROPYL)-8- AZABICYCLO(3.2.1)OCT-3-YL)-1-(1-METHYLETHYL)-2-OXO-1,2-DIHYDROQUINOLINE-3-CARBOXAMIDE

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

902622