Vitas-M small molecule compound
ethyl 5-cyano-6-({2-[(2,3-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK886208
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1cccc(c1Cl)Cl)c1ccccc1
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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 C27H21Cl2N3O4S MW 554.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21Cl2N3O4S/c1-2-35-27(34)23-22(20-12-7-13-36-20)17(14-30)26(32-25(23)16-8-4-3-5-9-16)37-15-21(33)31-19-11-6-10-18(28)24(19)29/h3-13,22,32H,2,15H2,1H3,(H,31,33)InChIKey
MOJYJFYNEKIZSC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=C(C(=CC=C3)Cl)Cl)C4=CC=CC=C4
ethyl5cyano6((2((23dichlorophenyl)amino)2oxoethyl)sulfanyl)4(furan2yl)2phenyl14dihydropyridine3carboxylate
ETHYL5CYANO6(2(23DICHLOROANILINO)2OXOETHYL)SULFANYL4(FURAN2YL)2PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC27H21Cl2N3O4Sc123527(34)2322(20127133620)17(1430)26(3225(23)168435916)371521(33)31191161018(28)24(19)29h3132232H215H21H3(H3133)
MFCD05033533
ZINC000101305291
ZINC000101305294
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