N-(3,4-dimethylphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dimethylphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Openeye Name: N-(3,4-dimethylphenyl)-3-methyl-4-(p-tolyl)piperazine-1-carbothioamide CAS Name: N-(3,4-dimethylphenyl)-3-methyl-4-(4-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dimethylphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Traditional Name: N-(3,4-dimethylphenyl)-3-methyl-4-(p-tolyl)piperazine-1-carbothioamide Formula: C21H27N3S MolecularWeight: 353.52418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H27N3S/c1-15-5-9-20(10-6-15)24-12-11-23(14-18(24)4)21(25)22-19-8-7-16(2)17(3)13-19/h5-10,13,18H,11-12,14H2,1-4H3,(H,22,25)