N-(4-methylsulfonylphenyl)-3-(3-oxidanylidene-4-phenethyl-quinoxalin-2-yl)propanamide

Systemtic Name: N-(4-methylsulfonylphenyl)-3-(3-oxidanylidene-4-phenethyl-quinoxalin-2-yl)propanamide Openeye Name: N-(4-methylsulfonylphenyl)-3-(3-oxo-4-phenethyl-quinoxalin-2-yl)propanamide CAS Name: N-(4-methylsulfonylphenyl)-3-(3-oxo-4-phenethyl-2-quinoxalinyl)propanamide IUPAC Name: N-(4-methylsulfonylphenyl)-3-(3-oxo-4-phenethylquinoxalin-2-yl)propanamide Traditional Name: 3-(3-keto-4-phenethyl-quinoxalin-2-yl)-N-(4-mesylphenyl)propionamide Formula: C26H25N3O4S MolecularWeight: 475.5594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC3=CC=CC=C3N(C2=O)CCC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC2=NC3=CC=CC=C3N(C2=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4S/c1-34(32,33)21-13-11-20(12-14-21)27-25(30)16-15-23-26(31)29(18-17-19-7-3-2-4-8-19)24-10-6-5-9-22(24)28-23/h2-14H,15-18H2,1H3,(H,27,30)