2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-1-(3-bromanyl-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-1-(3-bromanyl-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(3-bromo-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(3-bromo-4-methylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(3-bromo-4-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3-bromo-4-methyl-phenyl)-N-piperonyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C26H20BrN5O3 MolecularWeight: 530.3727

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N)Br

InChI

InChI=1S/C26H20BrN5O3/c1-14-6-8-16(11-17(14)27)32-24(28)22(23-25(32)31-19-5-3-2-4-18(19)30-23)26(33)29-12-15-7-9-20-21(10-15)35-13-34-20/h2-11H,12-13,28H2,1H3,(H,29,33)