7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]purine-2,6-dione

Systemtic Name: 7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]purine-2,6-dione Openeye Name: 7-(2-methoxyethyl)-3-methyl-8-(4-methylthiazol-2-yl)sulfanyl-purine-2,6-dione CAS Name: 7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-2-thiazolyl)thio]purine-2,6-dione IUPAC Name: 7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]purine-2,6-dione Traditional Name: 7-(2-methoxyethyl)-3-methyl-8-[(4-methylthiazol-2-yl)thio]xanthine Formula: C13H15N5O3S2 MolecularWeight: 353.4199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=NC3=C(N2CCOC)C(=O)NC(=O)N3C

Isomeric SMILES

CC1=CSC(=N1)SC2=NC3=C(N2CCOC)C(=O)NC(=O)N3C

InChI

InChI=1S/C13H15N5O3S2/c1-7-6-22-13(14-7)23-12-15-9-8(18(12)4-5-21-3)10(19)16-11(20)17(9)2/h6H,4-5H2,1-3H3,(H,16,19,20)