1-(4-methyl-3-nitro-phenyl)-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-methyl-3-nitro-phenyl)-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-(4-methyl-3-nitrophenyl)-2-(2-quinolinylthio)ethanone IUPAC Name: 1-(4-methyl-3-nitrophenyl)-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-(4-methyl-3-nitro-phenyl)-2-(2-quinolylthio)ethanone Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O3S/c1-12-6-7-14(10-16(12)20(22)23)17(21)11-24-18-9-8-13-4-2-3-5-15(13)19-18/h2-10H,11H2,1H3