Vitas-M small molecule compound
N-cyclopentyl-2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Catalog ID
STL183793
SMILES COc1cc(ccc1OC)c1nn2c(c1)c(=O)[nH]nc2SCC(=O)NC1CCCC1
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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 C20H23N5O4S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O4S/c1-28-16-8-7-12(9-17(16)29-2)14-10-15-19(27)22-23-20(25(15)24-14)30-11-18(26)21-13-5-3-4-6-13/h7-10,13H,3-6,11H2,1-2H3,(H,21,26)(H,22,27)InChIKey
LQCGLOSVFZLFTD-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C2=NN3C(=C2)C(=O)NN=C3SCC(=O)NC4CCCC4)OC
COc1cc(ccc1OC)c1nn2c(c1)c(=O)(nH)nc2SCC(=O)NC1CCCC1
InChI=1SC20H23N5O4Sc128168712(917(16)292)14101519(27)222320(25(15)2414)301118(26)2113534613h71013H3611H212H3(H2126)(H2227)
MFCD22386155
Ncyclopentyl2((2(34dimethoxyphenyl)4oxo45dihydropyrazolo(15d)(124)triazin7yl)sulfanyl)acetamide
Ncyclopentyl2((2(34dimethoxyphenyl)4oxo5Hpyrazolo(15d)(124)triazin7yl)sulfanyl)acetamide
ZINC000045925802
ZINC45925802
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