Vitas-M small molecule compound
methyl {4-[5-cyano-3,3-dimethyl-6-(methylsulfanyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-8-yl]piperazin-1-yl}acetate
Catalog ID
STL318951
SMILES COC(=O)CN1CCN(CC1)c1nc(SC)c(c2c1COC(C2)(C)C)C#N
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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 C19H26N4O3S MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N4O3S/c1-19(2)9-13-14(10-20)18(27-4)21-17(15(13)12-26-19)23-7-5-22(6-8-23)11-16(24)25-3/h5-9,11-12H2,1-4H3InChIKey
XMBJLXKCLIJJBQ-UHFFFAOYSA-NSynonyms
1441872-32-71441872327
CC1(CC2=C(C(=NC(=C2CO1)N3CCN(CC3)CC(=O)OC)SC)C#N)C
InChI=1SC19H26N4O3Sc119(2)91314(1020)18(274)2117(15(13)122619)237522(6823)1116(24)253h591112H214H3
methyl(4(5cyano33dimethyl6(methylsulfanyl)34dihydro1Hpyrano(34c)pyridin8yl)piperazin1yl)acetate
methyl2(4(5cyano33dimethyl6(methylthio)34dihydro1Hpyrano(34c)pyridin8yl)piperazin1yl)acetate
methyl2(4(5cyano33dimethyl6methylsulfanyl14dihydropyrano(34c)pyridin8yl)piperazin1yl)acetate
MFCD28031581
ZINC000095479704
ZINC95479704
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