Vitas-M small molecule compound
2-(benzylsulfanyl)-5-hydroxy-7,7-dimethyl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK562417
SMILES N#CC1=C(SCc2ccccc2)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 C28H30N2O4S MW 490.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O4S/c1-28(2)13-20-25(21(31)14-28)24(18-11-22(32-3)26(34-5)23(12-18)33-4)19(15-29)27(30-20)35-16-17-9-7-6-8-10-17/h6-12,24,31H,13-14,16H2,1-5H3InChIKey
CZIOVWZQUALWJO-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)5hydroxy77dimethyl4(345trimethoxyphenyl)4678tetrahydroquinoline3carbonitrile
MFCD03801769
ZINC000102512384
ZINC000102512390
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