Vitas-M small molecule compound
2'-bromo-6',6'-dimethyl-2-phenyl-2'-(prop-2-en-1-ylsulfanyl)-2,2',3,3',5',6'-hexahydro-1'H-spiro[chromene-4,4'-pyrimidin]-7-ol
Catalog ID
STK675760
SMILES C=CCSC1(Br)NC(C)(C)CC2(N1)CC(Oc1c2ccc(c1)O)c1ccccc1
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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 C23H27BrN2O2S MW 475.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27BrN2O2S/c1-4-12-29-23(24)25-21(2,3)15-22(26-23)14-20(16-8-6-5-7-9-16)28-19-13-17(27)10-11-18(19)22/h4-11,13,20,25-27H,1,12,14-15H2,2-3H3InChIKey
LBLNKOBDGQOXLL-UHFFFAOYSA-NSynonyms
2bromo44dimethyl2phenyl2prop2enylsulfanylspiro(13diazinane6423dihydrochromene)7ol
2bromo66dimethyl2phenyl2(prop2en1ylsulfanyl)223356hexahydro1Hspiro(chromene44pyrimidin)7ol
CC1(CC2(CC(OC3=C2C=CC(=C3)O)C4=CC=CC=C4)NC(N1)(SCC=C)Br)C
InChI=1SC23H27BrN2O2Sc14122923(24)2521(23)1522(2623)1420(168657916)28191317(27)101118(19)22h41113202527H1121415H223H3
MFCD01820466
ZINC000096834719
ZINC000096834722
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