2-[4-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylpiperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[4-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylpiperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Openeye Name: 2-[4-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]piperazin-1-yl]-1-(2-methyl-1-piperidyl)ethanone CAS Name: 2-[4-[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]-1-piperazinyl]-1-(2-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[4-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Traditional Name: 2-[4-[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]piperazino]-1-(2-methylpiperidino)ethanone Formula: C27H33N5O2S MolecularWeight: 491.64822

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C27H33N5O2S/c1-20-6-4-5-13-32(20)25(33)18-30-14-16-31(17-15-30)26(34)22-11-9-21(10-12-22)19-35-27-28-23-7-2-3-8-24(23)29-27/h2-3,7-12,20H,4-6,13-19H2,1H3,(H,28,29)