N-(3-acetamido-4-fluoranyl-phenyl)-2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(3-acetamido-4-fluoranyl-phenyl)-2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(3-acetamido-4-fluoro-phenyl)-2-[2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(3-acetamido-4-fluorophenyl)-2-[[2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-2-oxoethyl]thio]acetamide IUPAC Name: N-(3-acetamido-4-fluorophenyl)-2-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(3-acetamido-4-fluoro-phenyl)-2-[[2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethyl]thio]acetamide Formula: C23H24FN5O4S MolecularWeight: 485.531163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSCC(=O)NC3=CC(=C(C=C3)F)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSCC(=O)NC3=CC(=C(C=C3)F)NC(=O)C

InChI

InChI=1S/C23H24FN5O4S/c1-14-22(23(33)29(28(14)3)17-7-5-4-6-8-17)27-21(32)13-34-12-20(31)26-16-9-10-18(24)19(11-16)25-15(2)30/h4-11H,12-13H2,1-3H3,(H,25,30)(H,26,31)(H,27,32)