Vitas-M small molecule compound
benzyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-{[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826594
SMILES N#CC1=C(SCC(=O)Nc2cccc3c2cccc3)NC(=C(C1c1ccccc1Cl)C(=O)OCc1ccccc1)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 C33H26ClN3O3S MW 580.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26ClN3O3S/c1-21-30(33(39)40-19-22-10-3-2-4-11-22)31(25-15-7-8-16-27(25)34)26(18-35)32(36-21)41-20-29(38)37-28-17-9-13-23-12-5-6-14-24(23)28/h2-17,31,36H,19-20H2,1H3,(H,37,38)InChIKey
LFSKDZUPBUQISP-UHFFFAOYSA-NSynonyms
BENZYL4(2CHLOROPHENYL)5CYANO2METHYL6((2(1NAPHTHYLAMINO)2OXOETHYL)SULFANYL)14DIHYDRO3PYRIDINECARBOXYLATE
benzyl4(2chlorophenyl)5cyano2methyl6((2(naphthalen1ylamino)2oxoethyl)sulfanyl)14dihydropyridine3carboxylate
BENZYL4(2CHLOROPHENYL)5CYANO2METHYL6(2(NAPHTHALEN1YLAMINO)2OXOETHYL)SULFANYL14DIHYDROPYRIDINE3CARBOXYLATE
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC3=CC=CC=C32)C#N)C4=CC=CC=C4Cl)C(=O)OCC5=CC=CC=C5
InChI=1SC33H26ClN3O3Sc12130(33(39)401922103241122)31(2515781627(25)34)26(1835)32(3621)412029(38)3728179132312561424(23)28h2173136H1920H21H3(H3738)
MFCD03783652
ZINC000098043583
ZINC000098043584
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