Vitas-M small molecule compound
6-chloro-4-(2-chlorophenyl)-6',6'-dimethyl-2'-thioxo-2',3,3',4,5',6'-hexahydro-1'H-spiro[chromene-2,4'-pyrimidin]-7-yl acetate
Catalog ID
STK763730
SMILES S=C1NC(C)(C)CC2(N1)Oc1cc(OC(=O)C)c(cc1C(C2)c1ccccc1Cl)Cl
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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 C22H22Cl2N2O3S MW 465.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O3S/c1-12(27)28-19-9-18-14(8-17(19)24)15(13-6-4-5-7-16(13)23)10-22(29-18)11-21(2,3)25-20(30)26-22/h4-9,15H,10-11H2,1-3H3,(H2,25,26,30)InChIKey
WYOINXSZSIWJFB-UHFFFAOYSA-NSynonyms
(6chloro4(2chlorophenyl)44dimethyl2sulfanylidenespiro(13diazinane6234dihydrochromene)7yl)acetate6chloro4(2chlorophenyl)66dimethyl2thioxo233456hexahydro1Hspiro(chromene24pyrimidin)7ylacetate
CC(=O)OC1=C(C=C2C(CC3(CC(NC(=S)N3)(C)C)OC2=C1)C4=CC=CC=C4Cl)Cl
Registry IDs
MFCD02647436ZINC000003671905
ZINC000003671908
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