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

Systemtic Name: 2-chloranyl-N-[3-(4-methylphenyl)sulfonyl-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Openeye Name: 2-chloro-N-[1-phenethyl-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide CAS Name: 2-chloro-N-[3-(4-methylphenyl)sulfonyl-1-phenethyl-2-pyrrolo[3,2-b]quinoxalinyl]benzamide IUPAC Name: 2-chloro-N-[3-(4-methylphenyl)sulfonyl-1-phenethylpyrrolo[3,2-b]quinoxalin-2-yl]benzamide Traditional Name: 2-chloro-N-(1-phenethyl-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide Formula: C32H25ClN4O3S MolecularWeight: 581.0839

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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)CCC5=CC=CC=C5)NC(=O)C6=CC=CC=C6Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCC5=CC=CC=C5)NC(=O)C6=CC=CC=C6Cl

InChI

InChI=1S/C32H25ClN4O3S/c1-21-15-17-23(18-16-21)41(39,40)29-28-30(35-27-14-8-7-13-26(27)34-28)37(20-19-22-9-3-2-4-10-22)31(29)36-32(38)24-11-5-6-12-25(24)33/h2-18H,19-20H2,1H3,(H,36,38)