1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-(4-methoxyphenyl)thiourea Formula: C24H21ClN4OS MolecularWeight: 448.96774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H21ClN4OS/c1-30-22-13-11-20(12-14-22)27-24(31)26-15-18-16-29(21-5-3-2-4-6-21)28-23(18)17-7-9-19(25)10-8-17/h2-14,16H,15H2,1H3,(H2,26,27,31)