(2S)-2-(5,7-dimethoxy-4-phenyl-quinolin-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide

Systemtic Name: (2S)-2-(5,7-dimethoxy-4-phenyl-quinolin-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide Openeye Name: (2S)-2-[(5,7-dimethoxy-4-phenyl-2-quinolyl)sulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: (2S)-2-[(5,7-dimethoxy-4-phenyl-2-quinolinyl)thio]-N-(methylcarbamoyl)propanamide IUPAC Name: (2S)-2-(5,7-dimethoxy-4-phenylquinolin-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: (2S)-2-[(5,7-dimethoxy-4-phenyl-2-quinolyl)thio]-N-(methylcarbamoyl)propionamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)SC1=NC2=CC(=CC(=C2C(=C1)C3=CC=CC=C3)OC)OC

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)SC1=NC2=CC(=CC(=C2C(=C1)C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C22H23N3O4S/c1-13(21(26)25-22(27)23-2)30-19-12-16(14-8-6-5-7-9-14)20-17(24-19)10-15(28-3)11-18(20)29-4/h5-13H,1-4H3,(H2,23,25,26,27)/t13-/m0/s1