Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-5-hydroxy-7,7-dimethyl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK568854
SMILES N#CC1=C(SCc2ccccc2Cl)N=C2C(=C(O)CC(C2)(C)C)C1c1cc(OC)c(c(c1)OC)OC
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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 C28H29ClN2O4S MW 525.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN2O4S/c1-28(2)12-20-25(21(32)13-28)24(17-10-22(33-3)26(35-5)23(11-17)34-4)18(14-30)27(31-20)36-15-16-8-6-7-9-19(16)29/h6-11,24,32H,12-13,15H2,1-5H3InChIKey
XGBSBNIDFUVBAE-UHFFFAOYSA-NSynonyms
2((2chlorobenzyl)sulfanyl)5hydroxy77dimethyl4(345trimethoxyphenyl)4678tetrahydroquinoline3carbonitrile
MFCD05726482
ZINC000009244059
ZINC000009244060
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