N-(2-bromanyl-4-nitro-phenyl)-2-(7-methoxy-4-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-2-(7-methoxy-4-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-2-[(7-methoxy-4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-bromo-4-nitrophenyl)-2-[(7-methoxy-4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-2-(7-methoxy-4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-2-[(7-methoxy-4-methyl-2-quinolyl)thio]acetamide Formula: C19H16BrN3O4S MolecularWeight: 462.31704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC(=C2)OC)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=NC2=C1C=CC(=C2)OC)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H16BrN3O4S/c1-11-7-19(22-17-9-13(27-2)4-5-14(11)17)28-10-18(24)21-16-6-3-12(23(25)26)8-15(16)20/h3-9H,10H2,1-2H3,(H,21,24)