Vitas-M small molecule compound
3-(butan-2-yl)-6-methyl-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL086035
SMILES CCC(n1c(=S)[nH]c2c(c1=O)[nH]c(c2)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C11H15N3OS MW 237.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15N3OS/c1-4-7(3)14-10(15)9-8(13-11(14)16)5-6(2)12-9/h5,7,12H,4H2,1-3H3,(H,13,16)InChIKey
MFRGIFMYUMOZCO-UHFFFAOYSA-NSynonyms
3(butan2yl)6methyl2thioxo1235tetrahydro4Hpyrrolo(32d)pyrimidin4one
3butan2yl6methyl2sulfanylidene15dihydropyrrolo(32d)pyrimidin4one
CCC(C)N1C(=O)C2=C(C=C(N2)C)NC1=S
CCC(n1c(=S)(nH)c2c(c1=O)(nH)c(c2)C)C
InChI=1SC11H15N3OSc147(3)1410(15)98(1311(14)16)56(2)129h5712H4H213H3(H1316)
MFCD18203524
ZINC000101333013
ZINC000101333019
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