2-azanyl-N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]-1H-benzimidazole-4-carboxamide dihydrochloride

Systemtic Name: 2-azanyl-N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]-1H-benzimidazole-4-carboxamide dihydrochloride Openeye Name: 2-amino-N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]carbamoyl]phenyl]-1H-benzimidazole-4-carboxamide dihydrochloride CAS Name: 2-amino-N-[4-[[N,4-dimethyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]anilino]-oxomethyl]-2-methoxyphenyl]-1H-benzimidazole-4-carboxamide dihydrochloride IUPAC Name: 2-amino-N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]carbamoyl]phenyl]-1H-benzimidazole-4-carboxamide dihydrochloride Traditional Name: 2-amino-N-[4-[[2-[6-keto-6-(4-methylpiperazino)hexoxy]-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-phenyl]-1H-benzimidazole-4-carboxamide dihydrochloride Formula: C35H45Cl2N7O5 MolecularWeight: 714.6817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=C4C(=CC=C3)NC(=N4)N)OC)OCCCCCC(=O)N5CCN(CC5)C.Cl.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=C4C(=CC=C3)NC(=N4)N)OC)OCCCCCC(=O)N5CCN(CC5)C.Cl.Cl

InChI

InChI=1S/C35H43N7O5.2ClH/c1-23-12-15-28(30(21-23)47-20-7-5-6-11-31(43)42-18-16-40(2)17-19-42)41(3)34(45)24-13-14-26(29(22-24)46-4)37-33(44)25-9-8-10-27-32(25)39-35(36)38-27;;/h8-10,12-15,21-22H,5-7,11,16-20H2,1-4H3,(H,37,44)(H3,36,38,39);2*1H