4-[[2-(3-azanylpropoxy)phenyl]carbonylamino]-N-methyl-N-[[4-methyl-2-(4-methylpiperazin-1-yl)carbonyl-phenyl]methoxy]-2-phenyl-benzamide dihydrochloride

Systemtic Name: 4-[[2-(3-azanylpropoxy)phenyl]carbonylamino]-N-methyl-N-[[4-methyl-2-(4-methylpiperazin-1-yl)carbonyl-phenyl]methoxy]-2-phenyl-benzamide dihydrochloride Openeye Name: 4-[[2-(3-aminopropoxy)benzoyl]amino]-N-methyl-N-[[4-methyl-2-(4-methylpiperazine-1-carbonyl)phenyl]methoxy]-2-phenyl-benzamide dihydrochloride CAS Name: 4-[[[2-(3-aminopropoxy)phenyl]-oxomethyl]amino]-N-methyl-N-[[4-methyl-2-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]methoxy]-2-phenylbenzamide dihydrochloride IUPAC Name: 4-[[2-(3-aminopropoxy)benzoyl]amino]-N-methyl-N-[[4-methyl-2-(4-methylpiperazine-1-carbonyl)phenyl]methoxy]-2-phenylbenzamide dihydrochloride Traditional Name: 4-[[2-(3-aminopropoxy)benzoyl]amino]-N-methyl-N-[4-methyl-2-(4-methylpiperazine-1-carbonyl)benzyl]oxy-2-phenyl-benzamide dihydrochloride Formula: C38H45Cl2N5O5 MolecularWeight: 722.7004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CON(C)C(=O)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3OCCCN)C4=CC=CC=C4)C(=O)N5CCN(CC5)C.Cl.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)CON(C)C(=O)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3OCCCN)C4=CC=CC=C4)C(=O)N5CCN(CC5)C.Cl.Cl

InChI

InChI=1S/C38H43N5O5.2ClH/c1-27-14-15-29(34(24-27)38(46)43-21-19-41(2)20-22-43)26-48-42(3)37(45)31-17-16-30(25-33(31)28-10-5-4-6-11-28)40-36(44)32-12-7-8-13-35(32)47-23-9-18-39;;/h4-8,10-17,24-25H,9,18-23,26,39H2,1-3H3,(H,40,44);2*1H