2,2-dimethyl-3-(3-methylphenyl)sulfanyl-1-piperazin-1-yl-propan-1-one

Systemtic Name: 2,2-dimethyl-3-(3-methylphenyl)sulfanyl-1-piperazin-1-yl-propan-1-one Openeye Name: 2,2-dimethyl-3-(m-tolylsulfanyl)-1-piperazin-1-yl-propan-1-one CAS Name: 2,2-dimethyl-3-[(3-methylphenyl)thio]-1-(1-piperazinyl)-1-propanone IUPAC Name: 2,2-dimethyl-3-(3-methylphenyl)sulfanyl-1-piperazin-1-ylpropan-1-one Traditional Name: 2,2-dimethyl-3-(m-tolylthio)-1-piperazino-propan-1-one Formula: C16H24N2OS MolecularWeight: 292.43956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SCC(C)(C)C(=O)N2CCNCC2

Isomeric SMILES

CC1=CC(=CC=C1)SCC(C)(C)C(=O)N2CCNCC2

InChI

InChI=1S/C16H24N2OS/c1-13-5-4-6-14(11-13)20-12-16(2,3)15(19)18-9-7-17-8-10-18/h4-6,11,17H,7-10,12H2,1-3H3