Vitas-M small molecule compound
2-[(4-chlorobenzyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK700778
SMILES Clc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCCC3
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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 C21H21ClN2OS2 MW 417.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2OS2/c1-13(2)11-24-20(25)18-16-5-3-4-6-17(16)27-19(18)23-21(24)26-12-14-7-9-15(22)10-8-14/h7-10H,1,3-6,11-12H2,2H3InChIKey
ZBKRFANJUMTRQU-UHFFFAOYSA-NSynonyms
328069-23-42((4chlorobenzyl)sulfanyl)3(2methylprop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((4chlorobenzyl)thio)3(2methylallyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2((4chlorophenyl)methylsulfanyl)3(2methylprop2enyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
328069234
CC(=C)CN1C(=O)C2=C(N=C1SCC3=CC=C(C=C3)Cl)SC4=C2CCCC4
InChI=1SC21H21ClN2OS2c113(2)112420(25)1816534617(16)2719(18)2321(24)2612147915(22)10814h710H1361112H22H3
MFCD01557945
ZINC000002208093
ZINC02208093
ZINC2208093
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