3-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methylquinolin-4-yl)propanamide

Systemtic Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methyl-4-quinolyl)propanamide CAS Name: 3-(1,3-benzoxazol-2-ylthio)-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 3-(1,3-benzoxazol-2-ylthio)-N-(2-methyl-4-quinolyl)propionamide Formula: C20H17N3O2S MolecularWeight: 363.43288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)CCSC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)CCSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H17N3O2S/c1-13-12-17(14-6-2-3-7-15(14)21-13)22-19(24)10-11-26-20-23-16-8-4-5-9-18(16)25-20/h2-9,12H,10-11H2,1H3,(H,21,22,24)