2-(1-methylbenzimidazol-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propan-1-one CAS Name: 2-[(1-methyl-2-benzimidazolyl)thio]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylpropan-1-one Traditional Name: 1-(4-benzylpiperazino)-2-[(1-methylbenzimidazol-2-yl)thio]propan-1-one Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)SC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)SC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C22H26N4OS/c1-17(28-22-23-19-10-6-7-11-20(19)24(22)2)21(27)26-14-12-25(13-15-26)16-18-8-4-3-5-9-18/h3-11,17H,12-16H2,1-2H3