N-(2-methyl-5-nitro-phenyl)-2-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-methylsulfanyl-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-(methylthio)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-methylsulfanyl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 4-keto-N-(2-methyl-5-nitro-phenyl)-2-(methylthio)-1H-quinoline-3-carboxamide Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(NC3=CC=CC=C3C2=O)SC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(NC3=CC=CC=C3C2=O)SC

InChI

InChI=1S/C18H15N3O4S/c1-10-7-8-11(21(24)25)9-14(10)19-17(23)15-16(22)12-5-3-4-6-13(12)20-18(15)26-2/h3-9H,1-2H3,(H,19,23)(H,20,22)