N'-[2-[[2-[[3-[(1S)-1-[2-(3,4-dichlorophenyl)ethanoyl-methyl-amino]-2-pyrrolidin-1-yl-ethyl]phenyl]amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-N-[2-[[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]butanediamide

Systemtic Name: N'-[2-[[2-[[3-[(1S)-1-[2-(3,4-dichlorophenyl)ethanoyl-methyl-amino]-2-pyrrolidin-1-yl-ethyl]phenyl]amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-N-[2-[[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]butanediamide Openeye Name: N'-[2-[[2-[3-[(1S)-1-[[2-(3,4-dichlorophenyl)acetyl]-methyl-amino]-2-pyrrolidin-1-yl-ethyl]anilino]-2-oxo-ethyl]amino]-2-oxo-ethyl]-N-[2-[[2-(methylamino)-2-oxo-ethyl]amino]-2-oxo-ethyl]butanediamide CAS Name: N'-[2-[[2-[3-[(1S)-1-[[2-(3,4-dichlorophenyl)-1-oxoethyl]-methylamino]-2-(1-pyrrolidinyl)ethyl]anilino]-2-oxoethyl]amino]-2-oxoethyl]-N-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]butanediamide IUPAC Name: N'-[2-[[2-[3-[(1S)-1-[[2-(3,4-dichlorophenyl)acetyl]-methylamino]-2-pyrrolidin-1-ylethyl]anilino]-2-oxoethyl]amino]-2-oxoethyl]-N-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]butanediamide Traditional Name: N'-[2-[[2-[3-[(1S)-1-[[2-(3,4-dichlorophenyl)acetyl]-methyl-amino]-2-pyrrolidino-ethyl]anilino]-2-keto-ethyl]amino]-2-keto-ethyl]-N-[2-keto-2-[[2-keto-2-(methylamino)ethyl]amino]ethyl]succinamide Formula: C34H44Cl2N8O7 MolecularWeight: 747.66856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=O)CNC(=O)CCC(=O)NCC(=O)NCC(=O)NC1=CC=CC(=C1)C(CN2CCCC2)N(C)C(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CNC(=O)CNC(=O)CNC(=O)CCC(=O)NCC(=O)NCC(=O)NC1=CC=CC(=C1)[C@@H](CN2CCCC2)N(C)C(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C34H44Cl2N8O7/c1-37-30(47)17-40-31(48)18-38-28(45)10-11-29(46)39-19-32(49)41-20-33(50)42-24-7-5-6-23(16-24)27(21-44-12-3-4-13-44)43(2)34(51)15-22-8-9-25(35)26(36)14-22/h5-9,14,16,27H,3-4,10-13,15,17-21H2,1-2H3,(H,37,47)(H,38,45)(H,39,46)(H,40,48)(H,41,49)(H,42,50)/t27-/m1/s1