N-(5-chloranyl-2-nitro-phenyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-nitro-phenyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-nitro-phenyl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-nitrophenyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(5-chloro-2-nitrophenyl)-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-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=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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