N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-yl)-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: 2-(4-benzoyl-1-piperazinyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-(4-benzoylpiperazino)-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2S/c1-19-9-11-20(12-10-19)24(22-8-5-17-31-22)26-23(29)18-27-13-15-28(16-14-27)25(30)21-6-3-2-4-7-21/h2-12,17,24H,13-16,18H2,1H3,(H,26,29)