ethyl N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methylcarbamothioyl]carbamate

Systemtic Name: ethyl N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methylcarbamothioyl]carbamate Openeye Name: ethyl N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methylcarbamothioyl]carbamate CAS Name: N-[[[3,5-dimethyl-1-(2-methylphenyl)-4-pyrazolyl]methylamino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methylcarbamothioyl]carbamate Traditional Name: N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methylthiocarbamoyl]carbamic acid ethyl ester Formula: C17H22N4O2S MolecularWeight: 346.44718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NCC1=C(N(N=C1C)C2=CC=CC=C2C)C

Isomeric SMILES

CCOC(=O)NC(=S)NCC1=C(N(N=C1C)C2=CC=CC=C2C)C

InChI

InChI=1S/C17H22N4O2S/c1-5-23-17(22)19-16(24)18-10-14-12(3)20-21(13(14)4)15-9-7-6-8-11(15)2/h6-9H,5,10H2,1-4H3,(H2,18,19,22,24)