Vitas-M small molecule compound
2-{[5-(1,3-benzodioxol-5-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(pyrimidin-2-yl)acetamide
Catalog ID
STK808276
SMILES O=C(Nc1ncccn1)CSc1nnc(n1C)c1ccc2c(c1)OCO2
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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 C16H14N6O3S MW 370.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N6O3S/c1-22-14(10-3-4-11-12(7-10)25-9-24-11)20-21-16(22)26-8-13(23)19-15-17-5-2-6-18-15/h2-7H,8-9H2,1H3,(H,17,18,19,23)InChIKey
JBACRRWVHLGDBC-UHFFFAOYSA-NSynonyms
1021021-29-31021021293
2((5(13benzodioxol5yl)4methyl124triazol3yl)sulfanyl)Npyrimidin2ylacetamide
2((5(13benzodioxol5yl)4methyl4H124triazol3yl)sulfanyl)N(pyrimidin2yl)acetamide
2((5(BENZO(D)(13)DIOXOL5YL)4METHYL4H124TRIAZOL3YL)THIO)N(PYRIMIDIN2YL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=NC=CC=N2)C3=CC4=C(C=C3)OCO4
InChI=1SC16H14N6O3Sc12214(10341112(710)2592411)202116(22)26813(23)1915175261815h27H89H21H3(H17181923)
MFCD09982206
ZINC000011666899
ZINC11666899
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