N-(4,5-dimethyl-2-nitro-phenyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)-2-(2-quinolinylthio)acetamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(2-quinolylthio)acetamide Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H17N3O3S/c1-12-9-16(17(22(24)25)10-13(12)2)20-18(23)11-26-19-8-7-14-5-3-4-6-15(14)21-19/h3-10H,11H2,1-2H3,(H,20,23)