N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide

Systemtic Name: N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-[2-(dimethylamino)-2-oxo-ethyl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide CAS Name: N-[2-(dimethylamino)-2-oxoethyl]-4-[(4-fluorophenyl)thio]-3-nitrobenzamide IUPAC Name: N-[2-(dimethylamino)-2-oxoethyl]-4-(4-fluorophenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-[2-(dimethylamino)-2-keto-ethyl]-4-[(4-fluorophenyl)thio]-3-nitro-benzamide Formula: C17H16FN3O4S MolecularWeight: 377.390043

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNC(=O)C1=CC(=C(C=C1)SC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CNC(=O)C1=CC(=C(C=C1)SC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H16FN3O4S/c1-20(2)16(22)10-19-17(23)11-3-8-15(14(9-11)21(24)25)26-13-6-4-12(18)5-7-13/h3-9H,10H2,1-2H3,(H,19,23)