2-azanyl-7-[2,4-bis(oxidanyl)butyl]-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-7-[2,4-bis(oxidanyl)butyl]-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 2-amino-7-(2,4-dihydroxybutyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 2-amino-7-(2,4-dihydroxybutyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile IUPAC Name: 2-amino-7-(2,4-dihydroxybutyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 2-amino-7-(2,4-dihydroxybutyl)-4-keto-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C11H13N5O3 MolecularWeight: 263.25262

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(N1CC(CCO)O)NC(=NC2=O)N)C#N

Isomeric SMILES

C1=C(C2=C(N1CC(CCO)O)NC(=NC2=O)N)C#N

InChI

InChI=1S/C11H13N5O3/c12-3-6-4-16(5-7(18)1-2-17)9-8(6)10(19)15-11(13)14-9/h4,7,17-18H,1-2,5H2,(H3,13,14,15,19)