2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-(2-phenylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-(4-isobutyrylpiperazino)-N-[2-(phenylthio)phenyl]acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)CC(=O)NC2=CC=CC=C2SC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)CC(=O)NC2=CC=CC=C2SC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2S/c1-17(2)22(27)25-14-12-24(13-15-25)16-21(26)23-19-10-6-7-11-20(19)28-18-8-4-3-5-9-18/h3-11,17H,12-16H2,1-2H3,(H,23,26)