Vitas-M small molecule compound
4,5-bis(1,3-benzodioxol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK854518
SMILES S=c1[nH]nc(n1c1ccc2c(c1)OCO2)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 C16H11N3O4S MW 341.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O4S/c24-16-18-17-15(9-1-3-11-13(5-9)22-7-20-11)19(16)10-2-4-12-14(6-10)23-8-21-12/h1-6H,7-8H2,(H,18,24)InChIKey
ARLDRGKIAIQBBC-UHFFFAOYSA-NSynonyms
893766-93-334BIS(13BENZODIOXOL5YL)1H124TRIAZOLE5THIONE
45bis(13benzodioxol5yl)24dihydro3H124triazole3thione
893766933
C1OC2=C(O1)C=C(C=C2)C3=NNC(=S)N3C4=CC5=C(C=C4)OCO5
InChI=1SC16H11N3O4Sc2416181715(9131113(59)2272011)19(16)10241214(610)2382112h16H78H2(H1824)
MFCD08736000
S=c1(nH)nc(n1c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2
ZINC08743249
ZINC8743249
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