N-[4-(2,4-dimethylphenyl)piperazin-1-yl]carbothioylbenzamide

Systemtic Name: N-[4-(2,4-dimethylphenyl)piperazin-1-yl]carbothioylbenzamide Openeye Name: N-[4-(2,4-dimethylphenyl)piperazine-1-carbothioyl]benzamide CAS Name: N-[[4-(2,4-dimethylphenyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-[4-(2,4-dimethylphenyl)piperazine-1-carbothioyl]benzamide Traditional Name: N-[4-(2,4-dimethylphenyl)piperazine-1-carbothioyl]benzamide Formula: C20H23N3OS MolecularWeight: 353.48112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C(=S)NC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C(=S)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H23N3OS/c1-15-8-9-18(16(2)14-15)22-10-12-23(13-11-22)20(25)21-19(24)17-6-4-3-5-7-17/h3-9,14H,10-13H2,1-2H3,(H,21,24,25)