Vitas-M small molecule compound
2-[3-(4-chlorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Catalog ID
STL077687
SMILES O=C(Cn1c2ccsc2c(=O)n(c1=O)c1ccc(cc1)Cl)NCCC1=CCCCC1
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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 C22H22ClN3O3S MW 443.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O3S/c23-16-6-8-17(9-7-16)26-21(28)20-18(11-13-30-20)25(22(26)29)14-19(27)24-12-10-15-4-2-1-3-5-15/h4,6-9,11,13H,1-3,5,10,12,14H2,(H,24,27)InChIKey
SNTWVTBVUAGGQX-UHFFFAOYSA-NSynonyms
1260984-45-91260984459
2(3(4chlorophenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)N(2(cyclohex1en1yl)ethyl)acetamide
2(3(4chlorophenyl)24dioxothieno(32d)pyrimidin1yl)N(2(cyclohexen1yl)ethyl)acetamide
C1CCC(=CC1)CCNC(=O)CN2C3=C(C(=O)N(C2=O)C4=CC=C(C=C4)Cl)SC=C3
InChI=1SC22H22ClN3O3Sc23166817(9716)2621(28)2018(11133020)25(22(26)29)1419(27)241210154213515h4691113H135101214H2(H2427)
MFCD18198914
ZINC000057491739
ZINC57491739
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