1-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-3-(2-methylpropyl)thiourea

Systemtic Name: 1-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-3-(2-methylpropyl)thiourea Openeye Name: 1-isobutyl-3-[1-(o-tolylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-3-(2-methylpropyl)thiourea IUPAC Name: 1-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-3-(2-methylpropyl)thiourea Traditional Name: 1-isobutyl-3-[1-(2-methylbenzyl)pyrazol-4-yl]thiourea Formula: C16H22N4S MolecularWeight: 302.43768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NCC(C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NCC(C)C

InChI

InChI=1S/C16H22N4S/c1-12(2)8-17-16(21)19-15-9-18-20(11-15)10-14-7-5-4-6-13(14)3/h4-7,9,11-12H,8,10H2,1-3H3,(H2,17,19,21)