N-(3-chlorophenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide CAS Name: N-(3-chlorophenyl)-4-[2-(methylthio)phenyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-chlorophenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-4-[2-(methylthio)phenyl]piperazine-1-carbothioamide Formula: C18H20ClN3S2 MolecularWeight: 377.9545

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CSC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H20ClN3S2/c1-24-17-8-3-2-7-16(17)21-9-11-22(12-10-21)18(23)20-15-6-4-5-14(19)13-15/h2-8,13H,9-12H2,1H3,(H,20,23)