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

Systemtic Name: 3-[4-(3-methylphenyl)piperazin-1-yl]propanethioamide Openeye Name: 3-[4-(m-tolyl)piperazin-1-yl]propanethioamide CAS Name: 3-[4-(3-methylphenyl)-1-piperazinyl]propanethioamide IUPAC Name: 3-[4-(3-methylphenyl)piperazin-1-yl]propanethioamide Traditional Name: 3-[4-(m-tolyl)piperazino]thiopropionamide Formula: C14H21N3S MolecularWeight: 263.40164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCC(=S)N

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCC(=S)N

InChI

InChI=1S/C14H21N3S/c1-12-3-2-4-13(11-12)17-9-7-16(8-10-17)6-5-14(15)18/h2-4,11H,5-10H2,1H3,(H2,15,18)