ethyl 2-azanyl-1-[4-(phenylsulfonylamino)phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-[4-(phenylsulfonylamino)phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-amino-1-[4-(benzenesulfonamido)phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-[4-(benzenesulfonamido)phenyl]-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-[4-(benzenesulfonamido)phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-[4-(benzenesulfonamido)phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C25H21N5O4S MolecularWeight: 487.53034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5)N

InChI

InChI=1S/C25H21N5O4S/c1-2-34-25(31)21-22-24(28-20-11-7-6-10-19(20)27-22)30(23(21)26)17-14-12-16(13-15-17)29-35(32,33)18-8-4-3-5-9-18/h3-15,29H,2,26H2,1H3