Vitas-M small molecule compound
methyl 6-[(2-amino-2-oxoethyl)sulfanyl]-4-(2-chlorophenyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK075728
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)N
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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 C16H14ClN3O4S MW 379.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O4S/c1-24-16(23)13-12(8-4-2-3-5-10(8)17)9(6-18)15(20-14(13)22)25-7-11(19)21/h2-5,12-13H,7H2,1H3,(H2,19,21)(H,20,22)InChIKey
AEYPMWZYEXSZSY-UHFFFAOYSA-NSynonyms
COC(=O)C1C(=O)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)N
COC(=O)C1C(C(=C(NC1=O)SCC(=O)N)C#N)C2=CC=CC=C2Cl
InChI=1SC16H14ClN3O4Sc12416(23)1312(8423510(8)17)9(618)15(2014(13)22)25711(19)21h251213H7H21H3(H21921)(H2022)
METHYL6((2AMINO2OXOETHYL)SULFANYL)4(2CHLOROPHENYL)5CYANO2HYDROXY34DIHYDROPYRIDINE3CARBOXYLATE
methyl6((2amino2oxoethyl)sulfanyl)4(2chlorophenyl)5cyano2oxo1234tetrahydropyridine3carboxylate
methyl6((2amino2oxoethyl)thio)4(2chlorophenyl)5cyano2oxo1234tetrahydropyridine3carboxylate
METHYL6(2AMINO2OXOETHYL)SULFANYL4(2CHLOROPHENYL)5CYANO2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
METHYL6(CARBAMOYLMETHYLTHIO)4(2CHLOROPHENYL)5CYANO2OXO134TRIHYDROPYRIDINE3CARBOXYLATE
MFCD01461539
STK075728
ZINC000000716357
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