N-(2-chloranyl-5-nitro-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(4-methyl-2-quinolyl)thio]propionamide Formula: C19H16ClN3O3S MolecularWeight: 401.86664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H16ClN3O3S/c1-11-9-18(21-16-6-4-3-5-14(11)16)27-12(2)19(24)22-17-10-13(23(25)26)7-8-15(17)20/h3-10,12H,1-2H3,(H,22,24)