Vitas-M small molecule compound

methyl 5-cyano-6-[(2-methoxy-2-oxoethyl)sulfanyl]-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate

Catalog ID
STK725835
SMILES COC(=O)CSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccccc1OC

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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 C18H18N2O6S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O6S/c1-24-12-7-5-4-6-10(12)14-11(8-19)17(27-9-13(21)25-2)20-16(22)15(14)18(23)26-3/h4-7,14-15H,9H2,1-3H3,(H,20,22)
InChIKey
GHOGZMABNBYCRE-UHFFFAOYSA-N
Synonyms

COC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)OC)C(=O)OC
InChI=1SC18H18N2O6Sc12412754610(12)1411(819)17(27913(21)252)2016(22)15(14)18(23)263h471415H9H213H3(H2022)
methyl5cyano6((2methoxy2oxoethyl)sulfanyl)4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
methyl5cyano6((2methoxy2oxoethyl)thio)4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
METHYL5CYANO6(2METHOXY2OXOETHYL)SULFANYL4(2METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD01819543
ZINC000009110123
ZINC000009348027

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Available files

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