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

Systemtic Name: 7-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-xanthine Formula: C12H14N6O3S MolecularWeight: 322.34296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(S1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCOC1=NN=C(S1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C12H14N6O3S/c1-4-21-11-15-14-7(22-11)5-18-6-13-9-8(18)10(19)17(3)12(20)16(9)2/h6H,4-5H2,1-3H3