2-azanyl-5-(3-bromophenyl)-7-oxidanyl-4-oxidanylidene-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile

Systemtic Name: 2-azanyl-5-(3-bromophenyl)-7-oxidanyl-4-oxidanylidene-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Openeye Name: 2-amino-5-(3-bromophenyl)-7-hydroxy-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile CAS Name: 2-amino-5-(3-bromophenyl)-7-hydroxy-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile IUPAC Name: 2-amino-5-(3-bromophenyl)-7-hydroxy-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Traditional Name: 2-amino-5-(3-bromophenyl)-7-hydroxy-4-keto-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Formula: C14H9BrN4O3 MolecularWeight: 361.15026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2C(=C(OC3=C2C(=O)NC(=N3)N)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2C(=C(OC3=C2C(=O)NC(=N3)N)O)C#N

InChI

InChI=1S/C14H9BrN4O3/c15-7-3-1-2-6(4-7)9-8(5-16)13(21)22-12-10(9)11(20)18-14(17)19-12/h1-4,9,21H,(H3,17,18,19,20)