2-(1,3-benzoxazol-2-ylsulfanyl)-N-quinolin-3-yl-ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-quinolin-3-yl-ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-quinolyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-quinolinyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-quinolin-3-ylacetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-quinolyl)acetamide Formula: C18H13N3O2S MolecularWeight: 335.37972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C18H13N3O2S/c22-17(11-24-18-21-15-7-3-4-8-16(15)23-18)20-13-9-12-5-1-2-6-14(12)19-10-13/h1-10H,11H2,(H,20,22)