6-azanyl-7-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-5-phenethyl-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile

Systemtic Name: 6-azanyl-7-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-5-phenethyl-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Openeye Name: 6-amino-7-(6-bromo-4-oxo-1H-quinazolin-2-yl)-5-phenethyl-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile CAS Name: 6-amino-7-(6-bromo-4-oxo-1H-quinazolin-2-yl)-5-phenethylpyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile IUPAC Name: 6-amino-7-(6-bromo-4-oxo-1H-quinazolin-2-yl)-5-phenethylpyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Traditional Name: 6-amino-7-(6-bromo-4-keto-1H-quinazolin-2-yl)-5-phenethyl-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Formula: C24H15BrN8O MolecularWeight: 511.3329

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=C(C3=NC(=C(N=C32)C#N)C#N)C4=NC(=O)C5=C(N4)C=CC(=C5)Br)N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=C(C3=NC(=C(N=C32)C#N)C#N)C4=NC(=O)C5=C(N4)C=CC(=C5)Br)N

InChI

InChI=1S/C24H15BrN8O/c25-14-6-7-16-15(10-14)24(34)32-22(30-16)19-20-23(31-18(12-27)17(11-26)29-20)33(21(19)28)9-8-13-4-2-1-3-5-13/h1-7,10H,8-9,28H2,(H,30,32,34)