Vitas-M small molecule compound
ethyl (2E)-4-methyl-2-{[(3-phenyl-5,6-dihydro-1,4-oxathiin-2-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STK643756
SMILES CCOC(=O)c1s/c(=N/C(=O)C2=C(SCCO2)c2ccccc2)/[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 C18H18N2O4S2 MW 390.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S2/c1-3-23-17(22)14-11(2)19-18(26-14)20-16(21)13-15(25-10-9-24-13)12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,19,20,21)InChIKey
JVBDQTKKUCQBSD-UHFFFAOYSA-NSynonyms
1010891-26-51010891265
CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(SCCO2)C3=CC=CC=C3)C
CCOC(=O)c1sc(=NC(=O)C2=C(SCCO2)c2ccccc2)(nH)c1C
ethyl(2E)4methyl2(((3phenyl56dihydro14oxathiin2yl)carbonyl)imino)23dihydro13thiazole5carboxylate
ethyl4methyl2((5phenyl23dihydro14oxathiine6carbonyl)amino)13thiazole5carboxylate
InChI=1SC18H18N2O4S2c132317(22)1411(2)1918(2614)2016(21)1315(251092413)127546812h48H3910H212H3(H192021)
MFCD18163414
ZINC000012321290
ZINC12321290
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