N-[1-(1-phenylethyl)-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide

Systemtic Name: N-[1-(1-phenylethyl)-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Openeye Name: N-[3-(benzenesulfonyl)-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide CAS Name: N-[3-(benzenesulfonyl)-1-(1-phenylethyl)-2-pyrrolo[3,2-b]quinoxalinyl]benzamide IUPAC Name: N-[3-(benzenesulfonyl)-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Traditional Name: N-[3-besyl-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Formula: C31H24N4O3S MolecularWeight: 532.61226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)NC(=O)C6=CC=CC=C6

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)NC(=O)C6=CC=CC=C6

InChI

InChI=1S/C31H24N4O3S/c1-21(22-13-5-2-6-14-22)35-29-27(32-25-19-11-12-20-26(25)33-29)28(39(37,38)24-17-9-4-10-18-24)30(35)34-31(36)23-15-7-3-8-16-23/h2-21H,1H3,(H,34,36)