Vitas-M small molecule compound
ethyl 6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-(2-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827567
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)NCc1ccccc1
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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 C25H24ClN3O3S MW 482.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O3S/c1-3-32-25(31)22-16(2)29-24(19(13-27)23(22)18-11-7-8-12-20(18)26)33-15-21(30)28-14-17-9-5-4-6-10-17/h4-12,23,29H,3,14-15H2,1-2H3,(H,28,30)InChIKey
YBWHVSBKXLXSMZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C#N)SCC(=O)NCC3=CC=CC=C3)C
ethyl6((2(benzylamino)2oxoethyl)sulfanyl)4(2chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
ETHYL6(2(BENZYLAMINO)2OXOETHYL)SULFANYL4(2CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC25H24ClN3O3Sc133225(31)2216(2)2924(19(1327)23(22)1811781220(18)26)331521(30)28141795461017h4122329H31415H212H3(H2830)
MFCD03723931
ZINC000001144464
ZINC000001144466
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