3-[[6-methoxy-7-(2-methoxyethoxy)cinnolin-4-yl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 3-[[6-methoxy-7-(2-methoxyethoxy)cinnolin-4-yl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 3-[[6-methoxy-7-(2-methoxyethoxy)cinnolin-4-yl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 3-[[[6-methoxy-7-(2-methoxyethoxy)-4-cinnolinyl]thio]methyl]-N-phenylbenzamide IUPAC Name: 3-[[6-methoxy-7-(2-methoxyethoxy)cinnolin-4-yl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 3-[[[6-methoxy-7-(2-methoxyethoxy)cinnolin-4-yl]thio]methyl]-N-phenyl-benzamide Formula: C26H25N3O4S MolecularWeight: 475.5594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)N=NC=C2SCC3=CC=CC(=C3)C(=O)NC4=CC=CC=C4)OC

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)N=NC=C2SCC3=CC=CC(=C3)C(=O)NC4=CC=CC=C4)OC

InChI

InChI=1S/C26H25N3O4S/c1-31-11-12-33-24-15-22-21(14-23(24)32-2)25(16-27-29-22)34-17-18-7-6-8-19(13-18)26(30)28-20-9-4-3-5-10-20/h3-10,13-16H,11-12,17H2,1-2H3,(H,28,30)