Vitas-M small molecule compound
2-(butylsulfanyl)-4-(3,4-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK827261
SMILES CCCCSC1=C(C#N)C(CC(=O)N1)c1ccc(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 C18H22N2O3S MW 346.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3S/c1-4-5-8-24-18-14(11-19)13(10-17(21)20-18)12-6-7-15(22-2)16(9-12)23-3/h6-7,9,13H,4-5,8,10H2,1-3H3,(H,20,21)InChIKey
DGGDXAQPAFKYKV-UHFFFAOYSA-NSynonyms
2(butylsulfanyl)4(34dimethoxyphenyl)6oxo1456tetrahydropyridine3carbonitrile
6butylsulfanyl4(34dimethoxyphenyl)2oxo34dihydro1Hpyridine5carbonitrile
CCCCSC1=C(C(CC(=O)N1)C2=CC(=C(C=C2)OC)OC)C#N
InChI=1SC18H22N2O3Sc1458241814(1119)13(1017(21)2018)126715(222)16(912)233h67913H45810H213H3(H2021)
MFCD10087496
ZINC000012276338
ZINC000012276340
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