N-[bis(azanyl)methylidene]-1-isoquinolin-1-yl-pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-1-isoquinolin-1-yl-pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: N-(diaminomethylene)-1-(1-isoquinolyl)pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: N-(diaminomethylidene)-1-(1-isoquinolinyl)-3-pyrrolo[2,3-b]pyridinecarboxamide IUPAC Name: N-(diaminomethylidene)-1-isoquinolin-1-ylpyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: N-(diaminomethylene)-1-(1-isoquinolyl)pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C18H14N6O MolecularWeight: 330.34336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2N3C=C(C4=C3N=CC=C4)C(=O)N=C(N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2N3C=C(C4=C3N=CC=C4)C(=O)N=C(N)N

InChI

InChI=1S/C18H14N6O/c19-18(20)23-17(25)14-10-24(16-13(14)6-3-8-21-16)15-12-5-2-1-4-11(12)7-9-22-15/h1-10H,(H4,19,20,23,25)