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

Systemtic Name: 4-azanyl-7-[1,3-bis(oxidanyl)propoxymethyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4-amino-7-(1,3-dihydroxypropoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4-amino-7-(1,3-dihydroxypropoxymethyl)-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-7-(1,3-dihydroxypropoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4-amino-7-(1,3-dihydroxypropoxymethyl)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(N1COC(CCO)O)N=CN=C2N)C#N

Isomeric SMILES

C1=C(C2=C(N1COC(CCO)O)N=CN=C2N)C#N

InChI

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