Vitas-M small molecule compound
methyl (2Z)-2-({[1-(4-fluoro-1H-indazol-3-yl)-5-oxopyrrolidin-3-yl]carbonyl}imino)-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL318481
SMILES COC(=O)c1[nH]/c(=N/C(=O)C2CC(=O)N(C2)c2n[nH]c3c2c(F)ccc3)/sc1C(C)C
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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 C20H20FN5O4S MW 445.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN5O4S/c1-9(2)16-15(19(29)30-3)22-20(31-16)23-18(28)10-7-13(27)26(8-10)17-14-11(21)5-4-6-12(14)24-25-17/h4-6,9-10H,7-8H2,1-3H3,(H,24,25)(H,22,23,28)InChIKey
MIALYIYPTLGMID-UHFFFAOYSA-NSynonyms
1436005-78-51436005785
CC(C)C1=C(N=C(S1)NC(=O)C2CC(=O)N(C2)C3=NNC4=C3C(=CC=C4)F)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)C2CC(=O)N(C2)c2n(nH)c3c2c(F)ccc3)sc1C(C)C
InChI=1SC20H20FN5O4Sc19(2)1615(19(29)303)2220(3116)2318(28)10713(27)26(810)171411(21)54612(14)242517h46910H78H213H3(H2425)(H222328)
methyl(2Z)2(((1(4fluoro1Hindazol3yl)5oxopyrrolidin3yl)carbonyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2((1(4fluoro1Hindazol3yl)5oxopyrrolidine3carbonyl)amino)5propan2yl13thiazole4carboxylate
MFCD28031313
ZINC000095479339
ZINC000095479340
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