4,7-bis(azanyl)-2-oxidanylidene-5-phenyl-6-(phenylcarbonyl)-1H-pyrrolo[1,2-b]pyridazine-3-carbonitrile

Systemtic Name: 4,7-bis(azanyl)-2-oxidanylidene-5-phenyl-6-(phenylcarbonyl)-1H-pyrrolo[1,2-b]pyridazine-3-carbonitrile Openeye Name: 4,7-diamino-6-benzoyl-2-oxo-5-phenyl-1H-pyrrolo[1,2-b]pyridazine-3-carbonitrile CAS Name: 4,7-diamino-6-benzoyl-2-oxo-5-phenyl-1H-pyrrolo[1,2-b]pyridazine-3-carbonitrile IUPAC Name: 4,7-diamino-6-benzoyl-2-oxo-5-phenyl-1H-pyrrolo[1,2-b]pyridazine-3-carbonitrile Traditional Name: 4,7-diamino-6-benzoyl-2-keto-5-phenyl-1H-pyrrolo[1,2-b]pyridazine-3-carbonitrile Formula: C21H15N5O2 MolecularWeight: 369.3761

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=C(C(=O)NN3C(=C2C(=O)C4=CC=CC=C4)N)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=C(C(=O)NN3C(=C2C(=O)C4=CC=CC=C4)N)C#N)N

InChI

InChI=1S/C21H15N5O2/c22-11-14-17(23)18-15(12-7-3-1-4-8-12)16(20(24)26(18)25-21(14)28)19(27)13-9-5-2-6-10-13/h1-10H,23-24H2,(H,25,28)