5H-BENZO(B)CARBAZOLE-3-CARBONITRILE, 9-ETHYL-6,11-DIHYDRO-8-(4-((2-HYDROXYETHYL)AMINO)-1-PIPERIDINYL)-6,6-DIMETHYL-11-OXO-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H32N4O2
Molecular Weight	456.5793
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5H-BENZO(B)CARBAZOLE-3-CARBONITRILE, 9-ETHYL-6,11-DIHYDRO-8-(4-((2-HYDROXYETHYL)AMINO)-1-PIPERIDINYL)-6,6-DIMETHYL-11-OXO-

Structure Search

SMILES

CCC1=C(C=C2C(=C1)C(=O)C3=C(NC4=C3C=CC(=C4)C#N)C2(C)C)N5CCC(CC5)NCCO

InChI

InChIKey=XNKBNGIKXNABDO-UHFFFAOYSA-N

InChI=1S/C28H32N4O2/c1-4-18-14-21-22(15-24(18)32-10-7-19(8-11-32)30-9-12-33)28(2,3)27-25(26(21)34)20-6-5-17(16-29)13-23(20)31-27/h5-6,13-15,19,30-31,33H,4,7-12H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C28H32N4O2
Molecular Weight	456.5793
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 21:47:08 GMT 2025` Edited by `admin` on `Tue Apr 01 21:47:08 GMT 2025`
Record UNII	6L7WLR552I
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ALCETINIB METABOLITE M4

Preferred Name

English

5H-BENZO(B)CARBAZOLE-3-CARBONITRILE, 9-ETHYL-6,11-DIHYDRO-8-(4-((2-HYDROXYETHYL)AMINO)-1-PIPERIDINYL)-6,6-DIMETHYL-11-OXO-

Systematic Name

English

9-ETHYL-6,11-DIHYDRO-8-(4-((2-HYDROXYETHYL)AMINO)-1-PIPERIDINYL)-6,6-DIMETHYL-11-OXO-5H-BENZO(B)CARBAZOLE-3-CARBONITRILE

Systematic Name

English

Code System Code Type Description

PUBCHEM

66835300

Created by admin on Tue Apr 01 21:47:08 GMT 2025 , Edited by admin on Tue Apr 01 21:47:08 GMT 2025

PRIMARY

FDA UNII

6L7WLR552I

Created by admin on Tue Apr 01 21:47:08 GMT 2025 , Edited by admin on Tue Apr 01 21:47:08 GMT 2025

PRIMARY

CAS

1256585-04-2

Created by admin on Tue Apr 01 21:47:08 GMT 2025 , Edited by admin on Tue Apr 01 21:47:08 GMT 2025

PRIMARY

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