1-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-2-(4-propan-2-ylsulfanylphenyl)ethanone

Systemtic Name: 1-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-2-(4-propan-2-ylsulfanylphenyl)ethanone Openeye Name: 1-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-2-(4-isopropylsulfanylphenyl)ethanone CAS Name: 1-[4-(1H-benzimidazol-2-ylmethyl)-1-piperazinyl]-2-[4-(propan-2-ylthio)phenyl]ethanone IUPAC Name: 1-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-2-(4-propan-2-ylsulfanylphenyl)ethanone Traditional Name: 1-[4-(1H-benzimidazol-2-ylmethyl)piperazino]-2-[4-(isopropylthio)phenyl]ethanone Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H28N4OS/c1-17(2)29-19-9-7-18(8-10-19)15-23(28)27-13-11-26(12-14-27)16-22-24-20-5-3-4-6-21(20)25-22/h3-10,17H,11-16H2,1-2H3,(H,24,25)