5-[(2-azanyl-6-oxidanylidene-3,7-dihydropurin-8-yl)methyl]thiophene-3-carbonitrile

Systemtic Name: 5-[(2-azanyl-6-oxidanylidene-3,7-dihydropurin-8-yl)methyl]thiophene-3-carbonitrile Openeye Name: 5-[(2-amino-6-oxo-3,7-dihydropurin-8-yl)methyl]thiophene-3-carbonitrile CAS Name: 5-[(2-amino-6-oxo-3,7-dihydropurin-8-yl)methyl]-3-thiophenecarbonitrile IUPAC Name: 5-[(2-amino-6-oxo-3,7-dihydropurin-8-yl)methyl]thiophene-3-carbonitrile Traditional Name: 5-[(2-amino-6-keto-3,7-dihydropurin-8-yl)methyl]thiophene-3-carbonitrile Formula: C11H8N6OS MolecularWeight: 272.28582

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1C#N)CC2=NC3=C(N2)C(=O)N=C(N3)N

Isomeric SMILES

C1=C(SC=C1C#N)CC2=NC3=C(N2)C(=O)N=C(N3)N

InChI

InChI=1S/C11H8N6OS/c12-3-5-1-6(19-4-5)2-7-14-8-9(15-7)16-11(13)17-10(8)18/h1,4H,2H2,(H4,13,14,15,16,17,18)