Vitas-M small molecule compound
4-[4-(benzyloxy)phenyl]-6-hydroxy-2-(propylsulfanyl)-4,5-dihydropyridine-3-carbonitrile
Catalog ID
STK584066
SMILES CCCSC1=C(C#N)C(CC(=N1)O)c1ccc(cc1)OCc1ccccc1
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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 C22H22N2O2S MW 378.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O2S/c1-2-12-27-22-20(14-23)19(13-21(25)24-22)17-8-10-18(11-9-17)26-15-16-6-4-3-5-7-16/h3-11,19H,2,12-13,15H2,1H3,(H,24,25)InChIKey
FGKYWLUAQBBPPI-UHFFFAOYSA-NSynonyms
2OXO4(4PHENYLMETHOXYPHENYL)6PROPYLSULFANYL34DIHYDRO1HPYRIDINE5CARBONITRILE
4(4(benzyloxy)phenyl)6hydroxy2(propylsulfanyl)45dihydropyridine3carbonitrile
CCCSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C#N
InChI=1SC22H22N2O2Sc1212272220(1423)19(1321(25)2422)1781018(11917)2615166435716h31119H2121315H21H3(H2425)
MFCD07210846
ZINC000009015418
ZINC000009015419
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