N-(2-chloranyl-5-nitro-phenyl)-2-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(2-quinolylsulfanyl)propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-(2-quinolinylthio)propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-quinolin-2-ylsulfanylpropanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-(2-quinolylthio)propionamide Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H14ClN3O3S/c1-11(26-17-9-6-12-4-2-3-5-15(12)20-17)18(23)21-16-10-13(22(24)25)7-8-14(16)19/h2-11H,1H3,(H,21,23)