Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL031250
SMILES CC1CCN(CC1)C(=O)Cn1c(=O)n(Cc2ccc3c(c2)OCO3)c(=O)c2c1ccs2
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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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-14-4-7-23(8-5-14)19(26)12-24-16-6-9-31-20(16)21(27)25(22(24)28)11-15-2-3-17-18(10-15)30-13-29-17/h2-3,6,9-10,14H,4-5,7-8,11-13H2,1H3InChIKey
HTLYVYHWLHAZIS-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)1(2(4methylpiperidin1yl)2oxoethyl)thieno(32d)pyrimidine24(1H3H)dione
3(13benzodioxol5ylmethyl)1(2(4methylpiperidin1yl)2oxoethyl)thieno(32d)pyrimidine24dione
CC1CCN(CC1)C(=O)CN2C3=C(C(=O)N(C2=O)CC4=CC5=C(C=C4)OCO5)SC=C3
InChI=1SC22H23N3O5Sc1144723(8514)19(26)122416693120(16)21(27)25(22(24)28)1115231718(1015)30132917h23691014H45781113H21H3
MFCD18191314
ZINC000057428236
ZINC57428236
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