2-(3,7-dimethylquinolin-2-yl)sulfanyl-N-(2-methyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(3,7-dimethylquinolin-2-yl)sulfanyl-N-(2-methyl-4-nitro-phenyl)ethanamide Openeye Name: 2-[(3,7-dimethyl-2-quinolyl)sulfanyl]-N-(2-methyl-4-nitro-phenyl)acetamide CAS Name: 2-[(3,7-dimethyl-2-quinolinyl)thio]-N-(2-methyl-4-nitrophenyl)acetamide IUPAC Name: 2-(3,7-dimethylquinolin-2-yl)sulfanyl-N-(2-methyl-4-nitrophenyl)acetamide Traditional Name: 2-[(3,7-dimethyl-2-quinolyl)thio]-N-(2-methyl-4-nitro-phenyl)acetamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N3O3S/c1-12-4-5-15-9-14(3)20(22-18(15)8-12)27-11-19(24)21-17-7-6-16(23(25)26)10-13(17)2/h4-10H,11H2,1-3H3,(H,21,24)