Vitas-M small molecule compound
ethyl 1-({[3-(3-methylbutyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)piperidine-4-carboxylate
Catalog ID
STL073384
SMILES CCOC(=O)C1CCN(CC1)C(=O)CSc1nc2ccsc2c(=O)n1CCC(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 C21H29N3O4S2 MW 451.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O4S2/c1-4-28-20(27)15-6-9-23(10-7-15)17(25)13-30-21-22-16-8-12-29-18(16)19(26)24(21)11-5-14(2)3/h8,12,14-15H,4-7,9-11,13H2,1-3H3InChIKey
AIZDEWBHAUMNBE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC3=C(C(=O)N2CCC(C)C)SC=C3
ethyl1(((3(3methylbutyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)piperidine4carboxylate
ethyl1(2(3(3methylbutyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)piperidine4carboxylate
InChI=1SC21H29N3O4S2c142820(27)156923(10715)17(25)13302122168122918(16)19(26)24(21)11514(2)3h8121415H4791113H213H3
MFCD18194911
ZINC000057478592
ZINC57478592
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