1-[1-[(4-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl]-3-(4-ethanoylphenyl)thiourea

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl]-3-(4-ethanoylphenyl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-[1-[(4-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl]thiourea CAS Name: 1-(4-acetylphenyl)-3-[1-[(4-chlorophenyl)methyl]-5-methyl-3-pyrazolyl]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[1-[(4-chlorophenyl)methyl]-5-methylpyrazol-3-yl]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[1-(4-chlorobenzyl)-5-methyl-pyrazol-3-yl]thiourea Formula: C20H19ClN4OS MolecularWeight: 398.90906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)Cl)NC(=S)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)Cl)NC(=S)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C20H19ClN4OS/c1-13-11-19(24-25(13)12-15-3-7-17(21)8-4-15)23-20(27)22-18-9-5-16(6-10-18)14(2)26/h3-11H,12H2,1-2H3,(H2,22,23,24,27)