N-(2-nitrophenyl)-2-(3,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-nitrophenyl)-2-(3,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-nitrophenyl)-2-[(3,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-nitrophenyl)-2-[(3,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-nitrophenyl)-2-(3,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-nitrophenyl)-2-[(3,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3[N+](=O)[O-])C)C

InChI

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