3-bromanyl-N-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide

Systemtic Name: 3-bromanyl-N-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Openeye Name: N-[1-benzyl-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]-3-bromo-benzamide CAS Name: 3-bromo-N-[3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)-2-pyrrolo[3,2-b]quinoxalinyl]benzamide IUPAC Name: N-[1-benzyl-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-yl]-3-bromobenzamide Traditional Name: N-(1-benzyl-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl)-3-bromo-benzamide Formula: C31H23BrN4O3S MolecularWeight: 611.50832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CC=C5)NC(=O)C6=CC(=CC=C6)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CC=C5)NC(=O)C6=CC(=CC=C6)Br

InChI

InChI=1S/C31H23BrN4O3S/c1-20-14-16-24(17-15-20)40(38,39)28-27-29(34-26-13-6-5-12-25(26)33-27)36(19-21-8-3-2-4-9-21)30(28)35-31(37)22-10-7-11-23(32)18-22/h2-18H,19H2,1H3,(H,35,37)