3-[4-(3-methylphenyl)piperazin-1-yl]pentanethioamide

Systemtic Name: 3-[4-(3-methylphenyl)piperazin-1-yl]pentanethioamide Openeye Name: 3-[4-(m-tolyl)piperazin-1-yl]pentanethioamide CAS Name: 3-[4-(3-methylphenyl)-1-piperazinyl]pentanethioamide IUPAC Name: 3-[4-(3-methylphenyl)piperazin-1-yl]pentanethioamide Traditional Name: 3-[4-(m-tolyl)piperazino]thiovaleramide Formula: C16H25N3S MolecularWeight: 291.4548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=S)N)N1CCN(CC1)C2=CC=CC(=C2)C

Isomeric SMILES

CCC(CC(=S)N)N1CCN(CC1)C2=CC=CC(=C2)C

InChI

InChI=1S/C16H25N3S/c1-3-14(12-16(17)20)18-7-9-19(10-8-18)15-6-4-5-13(2)11-15/h4-6,11,14H,3,7-10,12H2,1-2H3,(H2,17,20)