3-(3,5-dimethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea

Systemtic Name: 3-(3,5-dimethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Openeye Name: 3-(3,5-dimethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea CAS Name: 3-(3,5-dimethylphenyl)-1-methyl-1-[(1-phenyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 3-(3,5-dimethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Traditional Name: 3-(3,5-dimethylphenyl)-1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]thiourea Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N(C)CC2=CN(N=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N(C)CC2=CN(N=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H22N4S/c1-15-9-16(2)11-18(10-15)22-20(25)23(3)13-17-12-21-24(14-17)19-7-5-4-6-8-19/h4-12,14H,13H2,1-3H3,(H,22,25)