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

Systemtic Name: 2-azanyl-N-(4-phenylbutan-2-yl)-1-[(E)-pyridin-3-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(1-methyl-3-phenyl-propyl)-1-[(E)-3-pyridylmethyleneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(4-phenylbutan-2-yl)-1-[(E)-3-pyridinylmethylideneamino]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(4-phenylbutan-2-yl)-1-[(E)-pyridin-3-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(1-methyl-3-phenyl-propyl)-1-[(E)-3-pyridylmethyleneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H25N7O MolecularWeight: 463.5337

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CN=CC=C5)N

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)/N=C/C5=CN=CC=C5)N

InChI

InChI=1S/C27H25N7O/c1-18(13-14-19-8-3-2-4-9-19)31-27(35)23-24-26(33-22-12-6-5-11-21(22)32-24)34(25(23)28)30-17-20-10-7-15-29-16-20/h2-12,15-18H,13-14,28H2,1H3,(H,31,35)/b30-17+