N-(4-fluoranyl-3-nitro-phenyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(4-fluoro-3-nitrophenyl)-2-[[2-(3-methylanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-2-[[2-keto-2-(m-toluidino)ethyl]thio]acetamide Formula: C17H16FN3O4S MolecularWeight: 377.390043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H16FN3O4S/c1-11-3-2-4-12(7-11)19-16(22)9-26-10-17(23)20-13-5-6-14(18)15(8-13)21(24)25/h2-8H,9-10H2,1H3,(H,19,22)(H,20,23)