1-[(3,4-dimethoxyphenyl)methyl]-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(benzenesulfonyl)-1-[(3,4-dimethoxyphenyl)methyl]pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(benzenesulfonyl)-1-[(3,4-dimethoxyphenyl)methyl]-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(benzenesulfonyl)-1-[(3,4-dimethoxyphenyl)methyl]pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: (3-besyl-1-veratryl-pyrrolo[3,2-b]quinoxalin-2-yl)amine Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)N)OC

InChI

InChI=1S/C25H22N4O4S/c1-32-20-13-12-16(14-21(20)33-2)15-29-24(26)23(34(30,31)17-8-4-3-5-9-17)22-25(29)28-19-11-7-6-10-18(19)27-22/h3-14H,15,26H2,1-2H3