1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-(2-methylphenyl)thiourea Openeye Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-(o-tolyl)thiourea CAS Name: 1-[(1,3-diphenyl-4-pyrazolyl)methyl]-1-methyl-3-(2-methylphenyl)thiourea IUPAC Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-(2-methylphenyl)thiourea Traditional Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-(o-tolyl)thiourea Formula: C25H24N4S MolecularWeight: 412.54986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4S/c1-19-11-9-10-16-23(19)26-25(30)28(2)17-21-18-29(22-14-7-4-8-15-22)27-24(21)20-12-5-3-6-13-20/h3-16,18H,17H2,1-2H3,(H,26,30)