2-azanyl-1-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-N-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-N-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-benzyl-1-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-N-(phenylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-benzyl-1-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-benzyl-1-[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H19BrN6O2 MolecularWeight: 515.36136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)NC=C5C=C(C=CC5=O)Br)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)NC=C5C=C(C=CC5=O)Br)N

InChI

InChI=1S/C25H19BrN6O2/c26-17-10-11-20(33)16(12-17)14-29-32-23(27)21(25(34)28-13-15-6-2-1-3-7-15)22-24(32)31-19-9-5-4-8-18(19)30-22/h1-12,14,29H,13,27H2,(H,28,34)