4-(4-cyanophenyl)-N-(4-methoxy-2-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-cyanophenyl)-N-(4-methoxy-2-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-cyanophenyl)-N-(4-methoxy-2-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-(4-cyanophenyl)-N-(4-methoxy-2-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-cyanophenyl)-N-(4-methoxy-2-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-cyanophenyl)-N-(4-methoxy-2-methyl-phenyl)piperazine-1-carbothioamide Formula: C20H22N4OS MolecularWeight: 366.47988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H22N4OS/c1-15-13-18(25-2)7-8-19(15)22-20(26)24-11-9-23(10-12-24)17-5-3-16(14-21)4-6-17/h3-8,13H,9-12H2,1-2H3,(H,22,26)