Vitas-M small molecule compound
3-(hexanoylamino)-5-methyl-4-oxo-2-sulfanyl-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylic acid
Catalog ID
STK441968
SMILES CCCCCC(=O)Nn1c(S)nc2c(c1=O)c(C)c(s2)C(=O)O
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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 C14H17N3O4S2 MW 355.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O4S2/c1-3-4-5-6-8(18)16-17-12(19)9-7(2)10(13(20)21)23-11(9)15-14(17)22/h3-6H2,1-2H3,(H,15,22)(H,16,18)(H,20,21)InChIKey
JSUDFAJPYQIRQK-UHFFFAOYSA-NSynonyms
3(hexanoylamino)5methyl4oxo2sulfanyl34dihydrothieno(23d)pyrimidine6carboxylicacid
3(HEXANOYLAMINO)5METHYL4OXO2SULFANYL3HYDROTHIOPHENO(23D)PYRIMIDINE6CARBOXYLICACID
3(hexanoylamino)5methyl4oxo2sulfanylidene1Hthieno(23d)pyrimidine6carboxylicacid
CCCCCC(=O)NN1C(=O)C2=C(NC1=S)SC(=C2C)C(=O)O
InChI=1SC14H17N3O4S2c134568(18)161712(19)97(2)10(13(20)21)2311(9)1514(17)22h36H212H3(H1522)(H1618)(H2021)
MFCD03900616
ZINC000017073472
ZINC17073472
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