Vitas-M small molecule compound
methyl {[3-cyano-6-oxo-4-(thiophen-3-yl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK760986
SMILES COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cscc1
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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 C13H12N2O3S2 MW 308.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N2O3S2/c1-18-12(17)7-20-13-10(5-14)9(4-11(16)15-13)8-2-3-19-6-8/h2-3,6,9H,4,7H2,1H3,(H,15,16)InChIKey
DEUNITGWHVVPNT-UHFFFAOYSA-NSynonyms
309280-06-6309280066
COC(=O)CSC1=C(C(CC(=O)N1)C2=CSC=C2)C#N
InChI=1SC13H12N2O3S2c11812(17)7201310(514)9(411(16)1513)8231968h2369H47H21H3(H1516)
methyl((3cyano6oxo4(thiophen3yl)1456tetrahydropyridin2yl)sulfanyl)acetate
methyl2((3cyano6oxo4(thiophen3yl)1456tetrahydropyridin2yl)thio)acetate
METHYL2((5CYANO2OXO4THIOPHEN3YL34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
MFCD01820286
ZINC000008973116
ZINC000008973117
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