1-methyl-9-propyl-8-(1,3-thiazol-2-yl)-3H-purine-2,6-dione

Systemtic Name: 1-methyl-9-propyl-8-(1,3-thiazol-2-yl)-3H-purine-2,6-dione Openeye Name: 1-methyl-9-propyl-8-thiazol-2-yl-3H-purine-2,6-dione CAS Name: 1-methyl-9-propyl-8-(2-thiazolyl)-3H-purine-2,6-dione IUPAC Name: 1-methyl-9-propyl-8-(1,3-thiazol-2-yl)-3H-purine-2,6-dione Traditional Name: 1-methyl-9-propyl-8-thiazol-2-yl-xanthine Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C(=O)N2)C)N=C1C3=NC=CS3

Isomeric SMILES

CCCN1C2=C(C(=O)N(C(=O)N2)C)N=C1C3=NC=CS3

InChI

InChI=1S/C12H13N5O2S/c1-3-5-17-8-7(11(18)16(2)12(19)15-8)14-9(17)10-13-4-6-20-10/h4,6H,3,5H2,1-2H3,(H,15,19)