Vitas-M small molecule compound
3-(piperidin-1-ylcarbonothioyl)phenyl (2E)-2-cyano-3-phenylprop-2-enoate
Catalog ID
STK378863
SMILES N#C/C(=C\c1ccccc1)/C(=O)Oc1cccc(c1)C(=S)N1CCCCC1
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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 C22H20N2O2S MW 376.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O2S/c23-16-19(14-17-8-3-1-4-9-17)22(25)26-20-11-7-10-18(15-20)21(27)24-12-5-2-6-13-24/h1,3-4,7-11,14-15H,2,5-6,12-13H2/b19-14+InChIKey
HGOROBLVDOASDI-XMHGGMMESA-NSynonyms
(3(PIPERIDINE1CARBOTHIOYL)PHENYL)(E)2CYANO3PHENYLPROP2ENOATE
3(piperidin1ylcarbonothioyl)phenyl(2E)2cyano3phenylprop2enoate
3(PIPERIDYLTHIOXOMETHYL)PHENYL(2E)2CYANO3PHENYLPROP2ENOATE
C1CCN(CC1)C(=S)C2=CC(=CC=C2)OC(=O)C(=CC3=CC=CC=C3)C#N
InChI=1SC22H20N2O2Sc231619(14178314917)22(25)26201171018(1520)21(27)24125261324h1347111415H2561213H2b1914+
MFCD01873964
N#CC(=Cc1ccccc1)C(=O)Oc1cccc(c1)C(=S)N1CCCCC1
ZINC000004503121
ZINC04503121
ZINC4503121
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