Vitas-M small molecule compound
methyl 4-(4-chlorophenyl)-5-cyano-2-oxo-6-[(2-oxo-2-propoxyethyl)sulfanyl]-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK543218
SMILES CCCOC(=O)CSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccc(cc1)Cl
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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 C19H19ClN2O5S MW 422.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O5S/c1-3-8-27-14(23)10-28-18-13(9-21)15(11-4-6-12(20)7-5-11)16(17(24)22-18)19(25)26-2/h4-7,15-16H,3,8,10H2,1-2H3,(H,22,24)InChIKey
IVWHWCQKBPMUGP-UHFFFAOYSA-NSynonyms
361478-18-4361478184
CCCOC(=O)CSC1=C(C(C(C(=O)N1)C(=O)OC)C2=CC=C(C=C2)Cl)C#N
InChI=1SC19H19ClN2O5Sc1382714(23)10281813(921)15(114612(20)7511)16(17(24)2218)19(25)262h471516H3810H212H3(H2224)
methyl4(4chlorophenyl)5cyano2oxo6((2oxo2propoxyethyl)sulfanyl)1234tetrahydropyridine3carboxylate
methyl4(4chlorophenyl)5cyano2oxo6((2oxo2propoxyethyl)thio)1234tetrahydropyridine3carboxylate
METHYL4(4CHLOROPHENYL)5CYANO2OXO6(2OXO2PROPOXYETHYL)SULFANYL34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD03290903
ZINC000009088856
ZINC000009330790
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