N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[2-(4-fluorophenyl)sulfanylethanoylamino]benzamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[2-(4-fluorophenyl)sulfanylethanoylamino]benzamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[[2-(4-fluorophenyl)sulfanylacetyl]amino]benzamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[[2-[(4-fluorophenyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[[2-(4-fluorophenyl)sulfanylacetyl]amino]benzamide Traditional Name: 3-[[2-[(4-fluorophenyl)thio]acetyl]amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzamide Formula: C26H23FN4O3S MolecularWeight: 490.549223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)CSC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)CSC4=CC=C(C=C4)F

InChI

InChI=1S/C26H23FN4O3S/c1-17-24(26(34)31(30(17)2)21-9-4-3-5-10-21)29-25(33)18-7-6-8-20(15-18)28-23(32)16-35-22-13-11-19(27)12-14-22/h3-15H,16H2,1-2H3,(H,28,32)(H,29,33)