N-[3-cyano-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]quinoxalin-2-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]quinoxalin-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]quinoxalin-2-yl]naphthalene-2-sulfonamide CAS Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-2-pyrrolo[3,2-b]quinoxalinyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]quinoxalin-2-yl]naphthalene-2-sulfonamide Traditional Name: N-(3-cyano-1-p-anisyl-pyrrolo[3,2-b]quinoxalin-2-yl)naphthalene-2-sulfonamide Formula: C29H21N5O3S MolecularWeight: 519.57374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C29H21N5O3S/c1-37-22-13-10-19(11-14-22)18-34-28(24(17-30)27-29(34)32-26-9-5-4-8-25(26)31-27)33-38(35,36)23-15-12-20-6-2-3-7-21(20)16-23/h2-16,33H,18H2,1H3