N-[4-[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[2-(3,5-dimethoxyanilino)-2-oxo-ethyl]sulfanylphenyl]-4-fluoro-benzamide CAS Name: N-[4-[[2-(3,5-dimethoxyanilino)-2-oxoethyl]thio]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]sulfanylphenyl]-4-fluorobenzamide Traditional Name: N-[4-[[2-(3,5-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(=CC(=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

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

InChI

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