Vitas-M small molecule compound
prop-2-en-1-yl 6-[(2-amino-2-oxoethyl)sulfanyl]-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK841592
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)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 C19H18ClN3O3S MW 403.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O3S/c1-3-8-26-19(25)16-11(2)23-18(27-10-15(22)24)14(9-21)17(16)12-4-6-13(20)7-5-12/h3-7,17,23H,1,8,10H2,2H3,(H2,22,24)InChIKey
BBCHWQXTNVDKAA-UHFFFAOYSA-NSynonyms
489442-76-4489442764
ALLYL6((2AMINO2OXOETHYL)THIO)4(4CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=C(C=C2)Cl)C(=O)OCC=C
InChI=1SC19H18ClN3O3Sc1382619(25)1611(2)2318(271015(22)24)14(921)17(16)124613(20)7512h371723H1810H22H3(H22224)
MFCD03297299
prop2en1yl6((2amino2oxoethyl)sulfanyl)4(4chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
PROP2ENYL6(2AMINO2OXOETHYL)SULFANYL4(4CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000020083339
ZINC000020083343
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