1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-3-(4-methylphenyl)thiourea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-3-(p-tolyl)thiourea CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-methyl-3-(4-methylphenyl)thiourea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-1-methyl-3-(4-methylphenyl)thiourea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-3-(p-tolyl)thiourea Formula: C21H24N4S MolecularWeight: 364.50706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H24N4S/c1-15-10-12-18(13-11-15)22-21(26)24(4)14-20-16(2)23-25(17(20)3)19-8-6-5-7-9-19/h5-13H,14H2,1-4H3,(H,22,26)