N-[4-oxidanylidene-4-[4-(2-phenylsulfanylethyl)piperazin-1-yl]butan-2-yl]benzamide

Systemtic Name: N-[4-oxidanylidene-4-[4-(2-phenylsulfanylethyl)piperazin-1-yl]butan-2-yl]benzamide Openeye Name: N-[1-methyl-3-oxo-3-[4-(2-phenylsulfanylethyl)piperazin-1-yl]propyl]benzamide CAS Name: N-[4-oxo-4-[4-[2-(phenylthio)ethyl]-1-piperazinyl]butan-2-yl]benzamide IUPAC Name: N-[4-oxo-4-[4-(2-phenylsulfanylethyl)piperazin-1-yl]butan-2-yl]benzamide Traditional Name: N-[3-keto-1-methyl-3-[4-[2-(phenylthio)ethyl]piperazino]propyl]benzamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)CCSC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)CCSC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2S/c1-19(24-23(28)20-8-4-2-5-9-20)18-22(27)26-14-12-25(13-15-26)16-17-29-21-10-6-3-7-11-21/h2-11,19H,12-18H2,1H3,(H,24,28)