Vitas-M small molecule compound
ethyl 4,5-dimethyl-2-{[(7-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK952960
SMILES CCOC(=O)c1c(NC(=O)C2OC(=O)c3c(C2)ccc(c3)C)sc(c1C)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 C20H21NO5S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5S/c1-5-25-20(24)16-11(3)12(4)27-18(16)21-17(22)15-9-13-7-6-10(2)8-14(13)19(23)26-15/h6-8,15H,5,9H2,1-4H3,(H,21,22)InChIKey
BBRJUNLTNUPQTI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2CC3=C(C=C(C=C3)C)C(=O)O2
ethyl45dimethyl2(((7methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)thiophene3carboxylate
ETHYL45DIMETHYL2((7METHYL1OXO34DIHYDROISOCHROMENE3CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL45DIMETHYL2((7METHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC20H21NO5Sc152520(24)1611(3)12(4)2718(16)2117(22)159137610(2)814(13)19(23)2615h6815H59H214H3(H2122)
MFCD06438617
ZINC000004540075
ZINC000004540076
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