8-azanyl-1,3-dimethyl-2,4-bis(oxidanylidene)-6-thiophen-2-yl-purino[7,8-a]pyrimidine-7-carbonitrile

Systemtic Name: 8-azanyl-1,3-dimethyl-2,4-bis(oxidanylidene)-6-thiophen-2-yl-purino[7,8-a]pyrimidine-7-carbonitrile Openeye Name: 8-amino-1,3-dimethyl-2,4-dioxo-6-(2-thienyl)purino[7,8-a]pyrimidine-7-carbonitrile CAS Name: 8-amino-1,3-dimethyl-2,4-dioxo-6-thiophen-2-yl-7-purino[7,8-a]pyrimidinecarbonitrile IUPAC Name: 8-amino-1,3-dimethyl-2,4-dioxo-6-thiophen-2-ylpurino[7,8-a]pyrimidine-7-carbonitrile Traditional Name: 8-amino-2,4-diketo-1,3-dimethyl-6-(2-thienyl)purino[7,8-a]pyrimidine-7-carbonitrile Formula: C15H11N7O2S MolecularWeight: 353.35854

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C(=C(C(=NC3=N2)N)C#N)C4=CC=CS4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C(=C(C(=NC3=N2)N)C#N)C4=CC=CS4

InChI

InChI=1S/C15H11N7O2S/c1-20-12-10(13(23)21(2)15(20)24)22-9(8-4-3-5-25-8)7(6-16)11(17)18-14(22)19-12/h3-5H,1-2H3,(H2,17,18,19)