Vitas-M small molecule compound
ethyl 2-amino-6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyanopyridine-3-carboxylate
Catalog ID
STL194346
SMILES CCOC(=O)c1cc(C#N)c(nc1N)SCC(=O)NCc1ccccc1
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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 C18H18N4O3S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3S/c1-2-25-18(24)14-8-13(9-19)17(22-16(14)20)26-11-15(23)21-10-12-6-4-3-5-7-12/h3-8H,2,10-11H2,1H3,(H2,20,22)(H,21,23)InChIKey
HPNLDVHMMRDFTC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NCC2=CC=CC=C2)N
ETHYL2AMINO5CYANO6((NBENZYLCARBAMOYL)METHYLTHIO)PYRIDINE3CARBOXYLATE
ethyl2amino6((2(benzylamino)2oxoethyl)sulfanyl)5cyanopyridine3carboxylate
ethyl2amino6(2(benzylamino)2oxoethyl)sulfanyl5cyanopyridine3carboxylate
InChI=1SC18H18N4O3Sc122518(24)14813(919)17(2216(14)20)261115(23)2110126435712h38H21011H21H3(H22022)(H2123)
MFCD00364483
ZINC000059499050
ZINC59499050
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