N-[1-(phenylmethyl)-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]propanamide

Systemtic Name: N-[1-(phenylmethyl)-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]propanamide Openeye Name: N-[3-(benzenesulfonyl)-1-benzyl-pyrrolo[3,2-b]quinoxalin-2-yl]propanamide CAS Name: N-[3-(benzenesulfonyl)-1-(phenylmethyl)-2-pyrrolo[3,2-b]quinoxalinyl]propanamide IUPAC Name: N-[3-(benzenesulfonyl)-1-benzylpyrrolo[3,2-b]quinoxalin-2-yl]propanamide Traditional Name: N-(1-benzyl-3-besyl-pyrrolo[3,2-b]quinoxalin-2-yl)propionamide Formula: C26H22N4O3S MolecularWeight: 470.54288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C2=NC3=CC=CC=C3N=C2N1CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCC(=O)NC1=C(C2=NC3=CC=CC=C3N=C2N1CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4O3S/c1-2-22(31)29-26-24(34(32,33)19-13-7-4-8-14-19)23-25(28-21-16-10-9-15-20(21)27-23)30(26)17-18-11-5-3-6-12-18/h3-16H,2,17H2,1H3,(H,29,31)