Vitas-M small molecule compound
2-{[(4-hydroxy-6-methylthieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}-N-[(2E)-5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Catalog ID
STK932015
SMILES O=C(/N=c/1\[nH]nc(s1)C1CCCO1)CSCc1nc(O)c2c(n1)sc(c2)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 C16H17N5O3S3 MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O3S3/c1-8-5-9-13(23)17-11(18-14(9)26-8)6-25-7-12(22)19-16-21-20-15(27-16)10-3-2-4-24-10/h5,10H,2-4,6-7H2,1H3,(H,17,18,23)(H,19,21,22)InChIKey
FUKVWUSXIMFIFV-UHFFFAOYSA-NSynonyms
1232817-16-11232817161
2(((4hydroxy6methylthieno(23d)pyrimidin2yl)methyl)sulfanyl)N((2E)5(tetrahydrofuran2yl)134thiadiazol2(3H)ylidene)acetamide
2((6methyl4oxo3Hthieno(23d)pyrimidin2yl)methylsulfanyl)N(5(oxolan2yl)134thiadiazol2yl)acetamide
CC1=CC2=C(S1)N=C(NC2=O)CSCC(=O)NC3=NN=C(S3)C4CCCO4
InChI=1SC16H17N5O3S3c185913(23)1711(1814(9)268)625712(22)1916212015(2716)103242410h510H2467H21H3(H171823)(H192122)
MFCD18177123
O=C(N=c1(nH)nc(s1)C1CCCO1)CSCc1nc(O)c2c(n1)sc(c2)C
ZINC000044892512
ZINC000044892515
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