Vitas-M small molecule compound
2-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK469726
SMILES O=c1[nH]c(SCc2cc(=O)n3c(n2)scc3)nc2c1c1CCCCc1s2
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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 C17H14N4O2S3 MW 402.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O2S3/c22-12-7-9(18-17-21(12)5-6-24-17)8-25-16-19-14(23)13-10-3-1-2-4-11(10)26-15(13)20-16/h5-7H,1-4,8H2,(H,19,20,23)InChIKey
YRCLDFDKKSTHSH-UHFFFAOYSA-NSynonyms
2(((5oxo5H(13)thiazolo(32a)pyrimidin7yl)methyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((5oxo(13)thiazolo(32a)pyrimidin7yl)methylsulfanyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC4=CC(=O)N5C=CSC5=N4
InChI=1SC17H14N4O2S3c221279(181721(12)562417)825161914(23)1310312411(10)2615(13)2016h57H148H2(H192023)
MFCD05404000
O=c1(nH)c(SCc2cc(=O)n3c(n2)scc3)nc2c1c1CCCCc1s2
ZINC000008640178
ZINC08640178
ZINC8640178
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