2-methoxy-N4-methyl-N4-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]-N1-(2-propan-2-yl-1H-benzimidazol-4-yl)benzene-1,4-dicarboxamide

Systemtic Name: 2-methoxy-N4-methyl-N4-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxidanylidene-hexoxy]phenyl]-N1-(2-propan-2-yl-1H-benzimidazol-4-yl)benzene-1,4-dicarboxamide Openeye Name: N1-(2-isopropyl-1H-benzimidazol-4-yl)-2-methoxy-N4-methyl-N4-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxo-hexoxy]phenyl]terephthalamide CAS Name: 2-methoxy-N4-methyl-N4-[4-methyl-2-[6-(4-methyl-1-piperazinyl)-6-oxohexoxy]phenyl]-N1-(2-propan-2-yl-1H-benzimidazol-4-yl)benzene-1,4-dicarboxamide IUPAC Name: 2-methoxy-4-N-methyl-4-N-[4-methyl-2-[6-(4-methylpiperazin-1-yl)-6-oxohexoxy]phenyl]-1-N-(2-propan-2-yl-1H-benzimidazol-4-yl)benzene-1,4-dicarboxamide Traditional Name: N-(2-isopropyl-1H-benzimidazol-4-yl)-N'-[2-[6-keto-6-(4-methylpiperazino)hexoxy]-4-methyl-phenyl]-2-methoxy-N'-methyl-terephthalamide Formula: C38H48N6O5 MolecularWeight: 668.82492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=CC4=C3N=C(N4)C(C)C)OC)OCCCCCC(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=CC4=C3N=C(N4)C(C)C)OC)OCCCCCC(=O)N5CCN(CC5)C

InChI

InChI=1S/C38H48N6O5/c1-25(2)36-39-29-11-10-12-30(35(29)41-36)40-37(46)28-16-15-27(24-32(28)48-6)38(47)43(5)31-17-14-26(3)23-33(31)49-22-9-7-8-13-34(45)44-20-18-42(4)19-21-44/h10-12,14-17,23-25H,7-9,13,18-22H2,1-6H3,(H,39,41)(H,40,46)