2-azanyl-N-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C24H16BrN5O3 MolecularWeight: 502.31954

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=C(N(C4=NC5=CC=CC=C5N=C34)C6=CC=C(C=C6)Br)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=C(N(C4=NC5=CC=CC=C5N=C34)C6=CC=C(C=C6)Br)N

InChI

InChI=1S/C24H16BrN5O3/c25-13-5-8-15(9-6-13)30-22(26)20(21-23(30)29-17-4-2-1-3-16(17)28-21)24(31)27-14-7-10-18-19(11-14)33-12-32-18/h1-11H,12,26H2,(H,27,31)