Vitas-M small molecule compound
ethyl (2E)-2-{[(6,7-dimethoxy-1-methyl-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)carbonyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STK656141
SMILES CCOC(=O)c1s/c(=N/C(=O)c2nn(c3c2Cc2c3cc(c(c2)OC)OC)C)/[nH]c1C
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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 C21H22N4O5S MW 442.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O5S/c1-6-30-20(27)18-10(2)22-21(31-18)23-19(26)16-13-7-11-8-14(28-4)15(29-5)9-12(11)17(13)25(3)24-16/h8-9H,6-7H2,1-5H3,(H,22,23,26)InChIKey
SHCYWUNHMFDCJU-UHFFFAOYSA-NSynonyms
1144455-66-21144455662
CCOC(=O)C1=C(N=C(S1)NC(=O)C2=NN(C3=C2CC4=CC(=C(C=C43)OC)OC)C)C
CCOC(=O)c1sc(=NC(=O)c2nn(c3c2Cc2c3cc(c(c2)OC)OC)C)(nH)c1C
ethyl(2E)2(((67dimethoxy1methyl14dihydroindeno(12c)pyrazol3yl)carbonyl)imino)4methyl23dihydro13thiazole5carboxylate
ethyl2((67dimethoxy1methyl4Hindeno(12c)pyrazole3carbonyl)amino)4methyl13thiazole5carboxylate
InChI=1SC21H22N4O5Sc163020(27)1810(2)2221(3118)2319(26)1613711814(284)15(295)912(11)17(13)25(3)2416h89H67H215H3(H222326)
MFCD18167590
ZINC000031815548
ZINC31815548
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