N-[3-[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[3-[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-fluoranyl-benzamide Openeye Name: N-[3-[2-(4-carbamoylanilino)-2-oxo-ethyl]sulfanylphenyl]-2-fluoro-benzamide CAS Name: N-[3-[[2-(4-carbamoylanilino)-2-oxoethyl]thio]phenyl]-2-fluorobenzamide IUPAC Name: N-[3-[2-(4-carbamoylanilino)-2-oxoethyl]sulfanylphenyl]-2-fluorobenzamide Traditional Name: N-[3-[[2-(4-carbamoylanilino)-2-keto-ethyl]thio]phenyl]-2-fluoro-benzamide Formula: C22H18FN3O3S MolecularWeight: 423.460023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)N)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)N)F

InChI

InChI=1S/C22H18FN3O3S/c23-19-7-2-1-6-18(19)22(29)26-16-4-3-5-17(12-16)30-13-20(27)25-15-10-8-14(9-11-15)21(24)28/h1-12H,13H2,(H2,24,28)(H,25,27)(H,26,29)