Vitas-M small molecule compound
N-[(2E)-5-tert-butyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-{[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Catalog ID
STK931450
SMILES O=C(/N=c/1\[nH]nc(s1)C(C)(C)C)CSCc1[nH]c(=O)c2c(n1)sc(c2C)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 C17H21N5O2S3 MW 423.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O2S3/c1-8-9(2)26-14-12(8)13(24)18-10(19-14)6-25-7-11(23)20-16-22-21-15(27-16)17(3,4)5/h6-7H2,1-5H3,(H,18,19,24)(H,20,22,23)InChIKey
UVVBPLDNXOMGNP-UHFFFAOYSA-NSynonyms
1190291-68-91190291689
CC1=C(SC2=C1C(=O)NC(=N2)CSCC(=O)NC3=NN=C(S3)C(C)(C)C)C
InChI=1SC17H21N5O2S3c189(2)261412(8)13(24)1810(1914)625711(23)2016222115(2716)17(34)5h67H215H3(H181924)(H202223)
MFCD18176955
N((2E)5tertbutyl134thiadiazol2(3H)ylidene)2(((56dimethyl4oxo34dihydrothieno(23d)pyrimidin2yl)methyl)sulfanyl)acetamide
N(5tertbutyl134thiadiazol2yl)2((56dimethyl4oxo3Hthieno(23d)pyrimidin2yl)methylsulfanyl)acetamide
O=C(N=c1(nH)nc(s1)C(C)(C)C)CSCc1(nH)c(=O)c2c(n1)sc(c2C)C
ZINC000036358108
ZINC36358108
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