4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-(3-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-(3-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-(m-tolyl)piperazine-1-carbothioamide CAS Name: 4-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-N-(3-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-(3-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-(m-tolyl)piperazine-1-carbothioamide Formula: C19H27N5S MolecularWeight: 357.51618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3)C)C

Isomeric SMILES

CCN1C(=C(C=N1)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3)C)C

InChI

InChI=1S/C19H27N5S/c1-4-24-16(3)17(13-20-24)14-22-8-10-23(11-9-22)19(25)21-18-7-5-6-15(2)12-18/h5-7,12-13H,4,8-11,14H2,1-3H3,(H,21,25)