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

Systemtic Name: N-[3-(4-methylphenyl)sulfonyl-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[1-phenethyl-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]naphthalene-2-sulfonamide CAS Name: N-[3-(4-methylphenyl)sulfonyl-1-phenethyl-2-pyrrolo[3,2-b]quinoxalinyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-(4-methylphenyl)sulfonyl-1-phenethylpyrrolo[3,2-b]quinoxalin-2-yl]naphthalene-2-sulfonamide Traditional Name: N-(1-phenethyl-3-tosyl-pyrrolo[3,2-b]quinoxalin-2-yl)naphthalene-2-sulfonamide Formula: C35H28N4O4S2 MolecularWeight: 632.75122

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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)NS(=O)(=O)C6=CC7=CC=CC=C7C=C6

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCC5=CC=CC=C5)NS(=O)(=O)C6=CC7=CC=CC=C7C=C6

InChI

InChI=1S/C35H28N4O4S2/c1-24-15-18-28(19-16-24)44(40,41)33-32-34(37-31-14-8-7-13-30(31)36-32)39(22-21-25-9-3-2-4-10-25)35(33)38-45(42,43)29-20-17-26-11-5-6-12-27(26)23-29/h2-20,23,38H,21-22H2,1H3