2-azanyl-1-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C29H23N7O4 MolecularWeight: 533.53742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=C(N(C4=NC5=CC=CC=C5N=C34)C6=CC7=C(C=C6)OCO7)N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=C(N(C4=NC5=CC=CC=C5N=C34)C6=CC7=C(C=C6)OCO7)N

InChI

InChI=1S/C29H23N7O4/c1-16-24(29(38)36(34(16)2)17-8-4-3-5-9-17)33-28(37)23-25-27(32-20-11-7-6-10-19(20)31-25)35(26(23)30)18-12-13-21-22(14-18)40-15-39-21/h3-14H,15,30H2,1-2H3,(H,33,37)