Vitas-M small molecule compound
4-[3-(benzyloxy)-4-methoxyphenyl]-2-(benzylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK860565
SMILES N#CC1=C(SCc2ccccc2)NC(=O)CC1c1ccc(c(c1)OCc1ccccc1)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 C27H24N2O3S MW 456.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O3S/c1-31-24-13-12-21(14-25(24)32-17-19-8-4-2-5-9-19)22-15-26(30)29-27(23(22)16-28)33-18-20-10-6-3-7-11-20/h2-14,22H,15,17-18H2,1H3,(H,29,30)InChIKey
BTQHAEFWHMOQMV-UHFFFAOYSA-NSynonyms
310454-19-4310454194
4(3(benzyloxy)4methoxyphenyl)2(benzylsulfanyl)6oxo1456tetrahydropyridine3carbonitrile
4(3(benzyloxy)4methoxyphenyl)2(benzylthio)6oxo1456tetrahydropyridine3carbonitrile
4(4METHOXY3(PHENYLMETHOXY)PHENYL)6OXO2(PHENYLMETHYLTHIO)145TRIHYDROPYRIDINE3CARBONITRILE
6BENZYLSULFANYL4(4METHOXY3PHENYLMETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
COC1=C(C=C(C=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CC=C3)OCC4=CC=CC=C4
InChI=1SC27H24N2O3Sc13124131221(1425(24)3217198425919)221526(30)2927(23(22)1628)331820106371120h21422H151718H21H3(H2930)
MFCD01464603
ZINC000009330747
ZINC000009374514
ZINC09374514
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