2-butyl-N'-[5-[[3-(2,4-dichlorophenyl)phenyl]methyl]-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(2-methylpropyl)butanediamide

Systemtic Name: 2-butyl-N'-[5-[[3-(2,4-dichlorophenyl)phenyl]methyl]-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(2-methylpropyl)butanediamide Openeye Name: 2-butyl-N'-[5-[[3-(2,4-dichlorophenyl)phenyl]methyl]-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-isobutyl-butanediamide CAS Name: 2-butyl-N'-[5-[[3-(2,4-dichlorophenyl)phenyl]methyl]-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(2-methylpropyl)butanediamide IUPAC Name: 2-butyl-N'-[5-[[3-(2,4-dichlorophenyl)phenyl]methyl]-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(2-methylpropyl)butanediamide Traditional Name: 2-butyl-N'-[5-[3-(2,4-dichlorophenyl)benzyl]-4-keto-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-isobutyl-succinamide Formula: C40H44Cl2N4O3 MolecularWeight: 699.70836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC(C)C)C(=O)NC1CN(C2=CC=CC=C2N(C1=O)CC3=CC=CC(=C3)C4=C(C=C(C=C4)Cl)Cl)C5=CC=CC=C5)C(=O)N

Isomeric SMILES

CCCCC(C(CC(C)C)C(=O)NC1CN(C2=CC=CC=C2N(C1=O)CC3=CC=CC(=C3)C4=C(C=C(C=C4)Cl)Cl)C5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C40H44Cl2N4O3/c1-4-5-16-32(38(43)47)33(21-26(2)3)39(48)44-35-25-45(30-14-7-6-8-15-30)36-17-9-10-18-37(36)46(40(35)49)24-27-12-11-13-28(22-27)31-20-19-29(41)23-34(31)42/h6-15,17-20,22-23,26,32-33,35H,4-5,16,21,24-25H2,1-3H3,(H2,43,47)(H,44,48)