2-(4-nitrophenyl)sulfanyl-N-quinolin-3-yl-propanamide

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-N-quinolin-3-yl-propanamide Openeye Name: 2-(4-nitrophenyl)sulfanyl-N-(3-quinolyl)propanamide CAS Name: 2-[(4-nitrophenyl)thio]-N-(3-quinolinyl)propanamide IUPAC Name: 2-(4-nitrophenyl)sulfanyl-N-quinolin-3-ylpropanamide Traditional Name: 2-[(4-nitrophenyl)thio]-N-(3-quinolyl)propionamide Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2N=C1)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2N=C1)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3S/c1-12(25-16-8-6-15(7-9-16)21(23)24)18(22)20-14-10-13-4-2-3-5-17(13)19-11-14/h2-12H,1H3,(H,20,22)