Vitas-M small molecule compound
ethyl 1-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)piperidine-3-carboxylate
Catalog ID
STL076172
SMILES CCOC(=O)C1CCCN(C1)C(=O)CSc1nc2ccsc2c(=O)n1c1ccc(cc1)Cl
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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 C22H22ClN3O4S2 MW 492.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O4S2/c1-2-30-21(29)14-4-3-10-25(12-14)18(27)13-32-22-24-17-9-11-31-19(17)20(28)26(22)16-7-5-15(23)6-8-16/h5-9,11,14H,2-4,10,12-13H2,1H3InChIKey
QPCBBOHXQNCTDY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCCN(C1)C(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)Cl)SC=C3
ethyl1(((3(4chlorophenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)piperidine3carboxylate
ethyl1(2(3(4chlorophenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)piperidine3carboxylate
InChI=1SC22H22ClN3O4S2c123021(29)14431025(1214)18(27)13322224179113119(17)20(28)26(22)167515(23)6816h591114H24101213H21H3
MFCD18197412
ZINC000067216682
ZINC000067216683
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