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

Systemtic Name: N-[1-(phenylmethyl)-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]ethanamide Openeye Name: N-[3-(benzenesulfonyl)-1-benzyl-pyrrolo[3,2-b]quinoxalin-2-yl]acetamide CAS Name: N-[3-(benzenesulfonyl)-1-(phenylmethyl)-2-pyrrolo[3,2-b]quinoxalinyl]acetamide IUPAC Name: N-[3-(benzenesulfonyl)-1-benzylpyrrolo[3,2-b]quinoxalin-2-yl]acetamide Traditional Name: N-(1-benzyl-3-besyl-pyrrolo[3,2-b]quinoxalin-2-yl)acetamide Formula: C25H20N4O3S MolecularWeight: 456.5163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20N4O3S/c1-17(30)26-25-23(33(31,32)19-12-6-3-7-13-19)22-24(28-21-15-9-8-14-20(21)27-22)29(25)16-18-10-4-2-5-11-18/h2-15H,16H2,1H3,(H,26,30)