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

Systemtic Name: N-[3-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide Openeye Name: N-[3-[2-(3,4-dimethylanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]-4-fluoro-benzamide CAS Name: N-[3-[[2-(3,4-dimethylanilino)-2-oxo-1-phenylethyl]thio]phenyl]-4-fluorobenzamide IUPAC Name: N-[3-[2-(3,4-dimethylanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]-4-fluorobenzamide Traditional Name: N-[3-[[2-(3,4-dimethylanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]-4-fluoro-benzamide Formula: C29H25FN2O2S MolecularWeight: 484.584403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C29H25FN2O2S/c1-19-11-16-25(17-20(19)2)32-29(34)27(21-7-4-3-5-8-21)35-26-10-6-9-24(18-26)31-28(33)22-12-14-23(30)15-13-22/h3-18,27H,1-2H3,(H,31,33)(H,32,34)