N-(2-chloranyl-4-nitro-phenyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C19H16ClN3O3S MolecularWeight: 401.86664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H16ClN3O3S/c1-11-4-3-5-14-12(2)8-18(22-19(11)14)27-10-17(24)21-16-7-6-13(23(25)26)9-15(16)20/h3-9H,10H2,1-2H3,(H,21,24)