Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-3-(4H-1,2,4-triazol-4-yl)thiourea
Catalog ID
STK453951
SMILES S=C(Nn1cnnc1)Nc1ccc2c(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 C10H9N5O2S MW 263.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9N5O2S/c18-10(14-15-4-11-12-5-15)13-7-1-2-8-9(3-7)17-6-16-8/h1-5H,6H2,(H2,13,14,18)InChIKey
NTZDOCCXALPETO-UHFFFAOYSA-NSynonyms
(2HBENZO(34D)13DIOXOLAN5YLAMINO)(124TRIAZOL4YLAMINO)METHANE1THIONE
1(13BENZODIOXOL5YL)3(124TRIAZOL4YL)THIOUREA
1(13benzodioxol5yl)3(4H124triazol4yl)thiourea
C1OC2=C(O1)C=C(C=C2)NC(=S)NN3C=NN=C3
InChI=1SC10H9N5O2Sc1810(141541112515)1371289(37)176168h15H6H2(H2131418)
MFCD04226423
ZINC000000611128
ZINC00611128
ZINC611128
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