N-(2-chloranyl-5-nitro-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(4-methyl-2-quinolyl)thio]acetamide Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H14ClN3O3S/c1-11-8-18(21-15-5-3-2-4-13(11)15)26-10-17(23)20-16-9-12(22(24)25)6-7-14(16)19/h2-9H,10H2,1H3,(H,20,23)