N-[4-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4-methyl-benzamide

Systemtic Name: N-[4-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4-methyl-benzamide Openeye Name: N-[4-[2-(3-chloro-4-fluoro-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]-4-methyl-benzamide CAS Name: N-[4-[[2-(3-chloro-4-fluoroanilino)-2-oxo-1-phenylethyl]thio]phenyl]-4-methylbenzamide IUPAC Name: N-[4-[2-(3-chloro-4-fluoroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]-4-methylbenzamide Traditional Name: N-[4-[[2-(3-chloro-4-fluoro-anilino)-2-keto-1-phenyl-ethyl]thio]phenyl]-4-methyl-benzamide Formula: C28H22ClFN2O2S MolecularWeight: 505.002883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C28H22ClFN2O2S/c1-18-7-9-20(10-8-18)27(33)31-21-11-14-23(15-12-21)35-26(19-5-3-2-4-6-19)28(34)32-22-13-16-25(30)24(29)17-22/h2-17,26H,1H3,(H,31,33)(H,32,34)