Vitas-M small molecule compound
methyl (2E)-2-{[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]imino}-5-(2-methoxyphenyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL244502
SMILES COC(=O)c1[nH]/c(=N\C(=O)c2cc3c(n2C)ccc(c3)F)/sc1c1ccccc1OC
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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 C22H18FN3O4S MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN3O4S/c1-26-15-9-8-13(23)10-12(15)11-16(26)20(27)25-22-24-18(21(28)30-3)19(31-22)14-6-4-5-7-17(14)29-2/h4-11H,1-3H3,(H,24,25,27)InChIKey
SRCIGYCYXWZGGU-UHFFFAOYSA-NSynonyms
1374545-44-41374545444
CN1C2=C(C=C(C=C2)F)C=C1C(=O)NC3=NC(=C(S3)C4=CC=CC=C4OC)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)c2cc3c(n2C)ccc(c3)F)sc1c1ccccc1OC
InChI=1SC22H18FN3O4Sc126159813(23)1012(15)1116(26)20(27)25222418(21(28)303)19(3122)14645717(14)292h411H13H3(H242527)
methyl(2E)2(((5fluoro1methyl1Hindol2yl)carbonyl)imino)5(2methoxyphenyl)23dihydro13thiazole4carboxylate
methyl2((5fluoro1methylindole2carbonyl)amino)5(2methoxyphenyl)13thiazole4carboxylate
MFCD24859968
ZINC000072404088
ZINC72404088
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