Vitas-M small molecule compound
4-(1,3-benzodioxol-5-yl)-2-(ethylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK839595
SMILES CCSC1=C(C#N)C(CC(=O)N1)c1ccc2c(c1)OCO2
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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 C15H14N2O3S MW 302.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O3S/c1-2-21-15-11(7-16)10(6-14(18)17-15)9-3-4-12-13(5-9)20-8-19-12/h3-5,10H,2,6,8H2,1H3,(H,17,18)InChIKey
XWPXQLYTIMPHDA-UHFFFAOYSA-NSynonyms
370847-50-0370847500
4(13benzodioxol5yl)2(ethylsulfanyl)6oxo1456tetrahydropyridine3carbonitrile
4(13BENZODIOXOL5YL)6ETHYLSULFANYL2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
4(benzo(d)(13)dioxol5yl)2(ethylthio)6oxo1456tetrahydropyridine3carbonitrile
CCSC1=C(C(CC(=O)N1)C2=CC3=C(C=C2)OCO3)C#N
InChI=1SC15H14N2O3Sc12211511(716)10(614(18)1715)9341213(59)2081912h3510H268H21H3(H1718)
MFCD02737861
ZINC000009363632
ZINC000009363633
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