N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]-3-methyl-benzimidazole-4-carboxamide

Systemtic Name: N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]carbamoyl]phenyl]-3-methyl-benzimidazole-4-carboxamide Openeye Name: N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]carbamoyl]phenyl]-3-methyl-benzimidazole-4-carboxamide CAS Name: N-[4-[[N,4-dimethyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]anilino]-oxomethyl]-2-methoxyphenyl]-3-methyl-4-benzimidazolecarboxamide IUPAC Name: N-[2-methoxy-4-[methyl-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]carbamoyl]phenyl]-3-methylbenzimidazole-4-carboxamide Traditional Name: N-[4-[[2-[6-keto-6-(4-methylpiperazino)hexoxy]-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-phenyl]-3-methyl-benzimidazole-4-carboxamide Formula: C36H44N6O5 MolecularWeight: 640.77176

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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)N=CN4C)OC)OCCCCCC(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=C4C(=CC=C3)N=CN4C)OC)OCCCCCC(=O)N5CCN(CC5)C

InChI

InChI=1S/C36H44N6O5/c1-25-13-16-30(32(22-25)47-21-8-6-7-12-33(43)42-19-17-39(2)18-20-42)41(4)36(45)26-14-15-28(31(23-26)46-5)38-35(44)27-10-9-11-29-34(27)40(3)24-37-29/h9-11,13-16,22-24H,6-8,12,17-21H2,1-5H3,(H,38,44)