N-(5-bromanylquinolin-8-yl)-3-(2-chloranyl-4-nitro-phenyl)sulfanyl-propanamide

Systemtic Name: N-(5-bromanylquinolin-8-yl)-3-(2-chloranyl-4-nitro-phenyl)sulfanyl-propanamide Openeye Name: N-(5-bromo-8-quinolyl)-3-(2-chloro-4-nitro-phenyl)sulfanyl-propanamide CAS Name: N-(5-bromo-8-quinolinyl)-3-[(2-chloro-4-nitrophenyl)thio]propanamide IUPAC Name: N-(5-bromoquinolin-8-yl)-3-(2-chloro-4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(5-bromo-8-quinolyl)-3-[(2-chloro-4-nitro-phenyl)thio]propionamide Formula: C18H13BrClN3O3S MolecularWeight: 466.73612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)NC(=O)CCSC3=C(C=C(C=C3)[N+](=O)[O-])Cl)Br

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)NC(=O)CCSC3=C(C=C(C=C3)[N+](=O)[O-])Cl)Br

InChI

InChI=1S/C18H13BrClN3O3S/c19-13-4-5-15(18-12(13)2-1-8-21-18)22-17(24)7-9-27-16-6-3-11(23(25)26)10-14(16)20/h1-6,8,10H,7,9H2,(H,22,24)