N-[4-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[2-(2,4-dimethoxyanilino)-2-oxo-ethyl]sulfanylphenyl]-4-fluoro-benzamide CAS Name: N-[4-[[2-(2,4-dimethoxyanilino)-2-oxoethyl]thio]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylphenyl]-4-fluorobenzamide Traditional Name: N-[4-[[2-(2,4-dimethoxyanilino)-2-keto-ethyl]thio]phenyl]-4-fluoro-benzamide Formula: C23H21FN2O4S MolecularWeight: 440.487243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C23H21FN2O4S/c1-29-18-9-12-20(21(13-18)30-2)26-22(27)14-31-19-10-7-17(8-11-19)25-23(28)15-3-5-16(24)6-4-15/h3-13H,14H2,1-2H3,(H,25,28)(H,26,27)