Vitas-M small molecule compound
ethyl 5-cyano-2-methyl-5-(prop-2-en-1-yl)-4-(thiophen-2-yl)-6-thioxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK885679
SMILES C=CCC1(C#N)C(=S)NC(=C(C1c1cccs1)C(=O)OCC)C
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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 C17H18N2O2S2 MW 346.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O2S2/c1-4-8-17(10-18)14(12-7-6-9-23-12)13(15(20)21-5-2)11(3)19-16(17)22/h4,6-7,9,14H,1,5,8H2,2-3H3,(H,19,22)InChIKey
OBNQAGAKVGGLCA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=S)C(C1C2=CC=CS2)(CC=C)C#N)C
ethyl5cyano2methyl5(prop2en1yl)4(thiophen2yl)6thioxo1456tetrahydropyridine3carboxylate
ETHYL5CYANO2METHYL5PROP2ENYL6SULFANYLIDENE4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC17H18N2O2S2c14817(1018)14(127692312)13(15(20)2152)11(3)1916(17)22h467914H158H223H3(H1922)
MFCD05995638
ZINC000000614422
ZINC000101151893
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