2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[(3-cyano-7-methyl-2-quinolyl)sulfanyl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[(3-cyano-7-methyl-2-quinolinyl)thio]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-(3-cyano-7-methylquinolin-2-yl)sulfanyl-N-(3-nitrophenyl)acetamide Traditional Name: 2-[(3-cyano-7-methyl-2-quinolyl)thio]-N-(3-nitrophenyl)acetamide Formula: C19H14N4O3S MolecularWeight: 378.40446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C19H14N4O3S/c1-12-5-6-13-8-14(10-20)19(22-17(13)7-12)27-11-18(24)21-15-3-2-4-16(9-15)23(25)26/h2-9H,11H2,1H3,(H,21,24)