7-[(5-azanyl-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(5-azanyl-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-xanthine Formula: C10H11N7O2S MolecularWeight: 293.30504

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3=NN=C(S3)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3=NN=C(S3)N

InChI

InChI=1S/C10H11N7O2S/c1-15-7-6(8(18)16(2)10(15)19)17(4-12-7)3-5-13-14-9(11)20-5/h4H,3H2,1-2H3,(H2,11,14)