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

Systemtic Name: N-[4-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl]sulfanylphenyl]-4-fluoro-benzamide CAS Name: N-[4-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]thio]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanylphenyl]-4-fluorobenzamide Traditional Name: N-[4-[[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl]thio]phenyl]-4-fluoro-benzamide Formula: C22H18ClFN2O3S MolecularWeight: 444.906323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClFN2O3S/c1-29-20-11-8-17(12-19(20)23)25-21(27)13-30-18-9-6-16(7-10-18)26-22(28)14-2-4-15(24)5-3-14/h2-12H,13H2,1H3,(H,25,27)(H,26,28)