Vitas-M small molecule compound
3-(4-ethylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL369854
SMILES CCc1ccc(cc1)n1c(SCC(=O)N2CCCC2)nc2c(c1=O)c1CCCCc1s2
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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 C24H27N3O2S2 MW 453.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O2S2/c1-2-16-9-11-17(12-10-16)27-23(29)21-18-7-3-4-8-19(18)31-22(21)25-24(27)30-15-20(28)26-13-5-6-14-26/h9-12H,2-8,13-15H2,1H3InChIKey
LUESZXULGGQHFL-UHFFFAOYSA-NSynonyms
3(4ethylphenyl)2((2oxo2(pyrrolidin1yl)ethyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4ethylphenyl)2(2oxo2pyrrolidin1ylethyl)sulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N4CCCC4)SC5=C3CCCC5
InChI=1SC24H27N3O2S2c121691117(121016)2723(29)2118734819(18)3122(21)2524(27)301520(28)2613561426h912H281315H21H3
MFCD03864624
ZINC000000686593
ZINC00686593
ZINC686593
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