Vitas-M small molecule compound
5-(1,3-benzodioxol-5-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK231218
SMILES C=CCn1c(S)nnc1c1ccc2c(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 C12H11N3O2S MW 261.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O2S/c1-2-5-15-11(13-14-12(15)18)8-3-4-9-10(6-8)17-7-16-9/h2-4,6H,1,5,7H2,(H,14,18)InChIKey
SISWGCCVSKAIFN-UHFFFAOYSA-NSynonyms
77803-46-43(13BENZODIOXOL5YL)4PROP2ENYL1H124TRIAZOLE5THIONE
4ALLYL5(13BENZODIOXOL5YL)
4ALLYL5(13BENZODIOXOL5YL)4H124TRIAZOL3YLHYDROSULFIDE
4ALLYL5(13BENZODIOXOL5YL)4H124TRIAZOLE3THIOL
5(13benzodioxol5yl)4(prop2en1yl)4H124triazole3thiol
5(2H13BENZODIOXOL5YL)4(PROP2EN1YL)124TRIAZOLE3THIOL
77803464
C=CCN1C(=NNC1=S)C2=CC3=C(C=C2)OCO3
InChI=1SC12H11N3O2Sc1251511(131412(15)18)834910(68)177169h246H157H2(H1418)
MFCD03848612
ZINC000005624819
ZINC05624819
ZINC5624819
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