Vitas-M small molecule compound
7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Catalog ID
STL090338
SMILES CSc1nn2c(n1)ncc1c2ccn(c1=O)c1ccc2c(c1)OCCO2
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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 C17H13N5O3S MW 367.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O3S/c1-26-17-19-16-18-9-11-12(22(16)20-17)4-5-21(15(11)23)10-2-3-13-14(8-10)25-7-6-24-13/h2-5,8-9H,6-7H2,1H3InChIKey
ULEBHTOTFCUTFK-UHFFFAOYSA-NSynonyms
7(23dihydro14benzodioxin6yl)2(methylsulfanyl)pyrido(34e)(124)triazolo(15a)pyrimidin6(7H)one
CSC1=NN2C3=C(C=NC2=N1)C(=O)N(C=C3)C4=CC5=C(C=C4)OCCO5
InChI=1SC17H13N5O3Sc1261719161891112(22(16)2017)4521(15(11)23)10231314(810)25762413h2589H67H21H3
MFCD13872330
ZINC000030875357
ZINC30875357
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