2-azanyl-N-(3-methylbutyl)-1-[(E)-pyridin-4-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(3-methylbutyl)-1-[(E)-pyridin-4-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-isopentyl-1-[(E)-4-pyridylmethyleneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(3-methylbutyl)-1-[(E)-pyridin-4-ylmethylideneamino]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(3-methylbutyl)-1-[(E)-pyridin-4-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-isoamyl-1-[(E)-4-pyridylmethyleneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H23N7O MolecularWeight: 401.46432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=NC=C4)N

Isomeric SMILES

CC(C)CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=CC=NC=C4)N

InChI

InChI=1S/C22H23N7O/c1-14(2)7-12-25-22(30)18-19-21(28-17-6-4-3-5-16(17)27-19)29(20(18)23)26-13-15-8-10-24-11-9-15/h3-6,8-11,13-14H,7,12,23H2,1-2H3,(H,25,30)/b26-13+