Vitas-M small molecule compound
5-amino-1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N-(2,4-dimethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL081785
SMILES COc1ccc(c(c1)OC)NC(=O)c1nnn(c1N)CC(=O)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 C20H20N6O6 MW 440.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O6/c1-29-12-4-5-13(15(8-12)30-2)23-20(28)18-19(21)26(25-24-18)9-17(27)22-11-3-6-14-16(7-11)32-10-31-14/h3-8H,9-10,21H2,1-2H3,(H,22,27)(H,23,28)InChIKey
QPVFVUHPGPSKQT-UHFFFAOYSA-NSynonyms
5amino1(2(13benzodioxol5ylamino)2oxoethyl)N(24dimethoxyphenyl)1H123triazole4carboxamide
5amino1(2(13benzodioxol5ylamino)2oxoethyl)N(24dimethoxyphenyl)triazole4carboxamide
COC1=CC(=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=CC4=C(C=C3)OCO4)N)OC
InChI=1SC20H20N6O6c129124513(15(812)302)2320(28)1819(21)26(252418)917(27)2211361416(711)32103114h38H91021H212H3(H2227)(H2328)
MFCD14927917
ZINC000009226885
ZINC09226885
ZINC9226885
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