1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-2,2-diphenyl-ethanone

Systemtic Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-2,2-diphenyl-ethanone Openeye Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-2,2-diphenyl-ethanone CAS Name: 1-[4-[(4-chlorophenyl)thio]-3,5-dimethyl-1-pyrazolyl]-2,2-diphenylethanone IUPAC Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethylpyrazol-1-yl]-2,2-diphenylethanone Traditional Name: 1-[4-[(4-chlorophenyl)thio]-3,5-dimethyl-pyrazol-1-yl]-2,2-diphenyl-ethanone Formula: C25H21ClN2OS MolecularWeight: 432.96504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=NN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2OS/c1-17-24(30-22-15-13-21(26)14-16-22)18(2)28(27-17)25(29)23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-16,23H,1-2H3