N-(2-chloranyl-5-nitro-phenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(3-methyl-2-quinoxalinyl)thio]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(3-methylquinoxalin-2-yl)sulfanylpropanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(3-methylquinoxalin-2-yl)thio]propionamide Formula: C18H15ClN4O3S MolecularWeight: 402.8547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClN4O3S/c1-10-18(22-15-6-4-3-5-14(15)20-10)27-11(2)17(24)21-16-9-12(23(25)26)7-8-13(16)19/h3-9,11H,1-2H3,(H,21,24)