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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C35H28N4O4S2/c1-23-16-19-28(20-17-23)44(40,41)33-32-34(37-31-15-9-8-14-30(31)36-32)39(24(2)25-10-4-3-5-11-25)35(33)38-45(42,43)29-21-18-26-12-6-7-13-27(26)22-29/h3-22,24,38H,1-2H3