5-chloranyl-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[4-[(2,4-dimethylphenyl)thio]phenyl]-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[4-[(2,4-dimethylphenyl)thio]phenyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Formula: C25H21ClFN3OS MolecularWeight: 465.970143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)NC(=O)C3=C(N(N=C3C)C4=CC=C(C=C4)F)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)NC(=O)C3=C(N(N=C3C)C4=CC=C(C=C4)F)Cl)C

InChI

InChI=1S/C25H21ClFN3OS/c1-15-4-13-22(16(2)14-15)32-21-11-7-19(8-12-21)28-25(31)23-17(3)29-30(24(23)26)20-9-5-18(27)6-10-20/h4-14H,1-3H3,(H,28,31)