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Details

Stereochemistry	ACHIRAL
Molecular Formula	C41H50Cl2N12O5
Molecular Weight	861.819
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C=C(NC(=O)C2=CC(NC(=O)C3=CC(NC(=O)C4=CC(NC(=O)CCCC5=CC=C(C=C5)N(CCCl)CCCl)=CN4C)=CN3C)=CN2C)C=C1C(=O)NCCC(N)=N

InChI

InChIKey=DZKBSXOAGSYUMT-UHFFFAOYSA-N

InChI=1S/C41H50Cl2N12O5/c1-51-23-28(19-32(51)38(57)46-15-12-36(44)45)48-40(59)34-21-30(25-53(34)3)50-41(60)35-20-29(24-54(35)4)49-39(58)33-18-27(22-52(33)2)47-37(56)7-5-6-26-8-10-31(11-9-26)55(16-13-42)17-14-43/h8-11,18-25H,5-7,12-17H2,1-4H3,(H3,44,45)(H,46,57)(H,47,56)(H,48,59)(H,49,58)(H,50,60)

HIDE SMILES / InChI

Molecular Formula	C41H50Cl2N12O5
Molecular Weight	861.819
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 `Mon Mar 31 22:41:37 GMT 2025` Edited by `admin` on `Mon Mar 31 22:41:37 GMT 2025`
Record UNII	ZVA3DNA2GZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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Common Name

English

N-(5-(((5-(((3-AMINO-3-IMINOPROPYL)AMINO)CARBONYL)-1-METHYL-1H-PYRROL-3-YL)AMINO)CARBONYL)-1-METHYL-1H-PYRROL-3-YL)-4-(((4-((4-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)-1-OXOBUTYL)AMINO)-1-METHYL-1H-PYRROL-2-YL)CARBONYL)AMINO)-1-METHYL-1H-PYRROLE-2-CARBOXAMIDE

Preferred Name

English

Code System Code Type Description

FDA UNII

ZVA3DNA2GZ

Created by admin on Mon Mar 31 22:41:37 GMT 2025 , Edited by admin on Mon Mar 31 22:41:37 GMT 2025

PRIMARY

PUBCHEM

189868

Created by admin on Mon Mar 31 22:41:37 GMT 2025 , Edited by admin on Mon Mar 31 22:41:37 GMT 2025

PRIMARY

CAS

758659-97-1

Created by admin on Mon Mar 31 22:41:37 GMT 2025 , Edited by admin on Mon Mar 31 22:41:37 GMT 2025

PRIMARY

Related Record Type Details


					ZVA3DNA2GZ

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