Vitas-M small molecule compound
prop-2-en-1-yl 6-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826608
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1cc(Cl)ccc1OC
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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 C26H23Cl2N3O4S MW 544.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2N3O4S/c1-4-11-35-26(33)23-15(2)30-25(18(13-29)24(23)17-7-5-6-8-19(17)28)36-14-22(32)31-20-12-16(27)9-10-21(20)34-3/h4-10,12,24,30H,1,11,14H2,2-3H3,(H,31,32)InChIKey
AVVGTQRBYYKYDQ-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)SCC(=O)NC2=C(C=CC(=C2)Cl)OC)C#N)C3=CC=CC=C3Cl)C(=O)OCC=C
InChI=1SC26H23Cl2N3O4Sc14113526(33)2315(2)3025(18(1329)24(23)17756819(17)28)361422(32)31201216(27)91021(20)343h410122430H11114H223H3(H3132)
MFCD10086577
prop2en1yl6((2((5chloro2methoxyphenyl)amino)2oxoethyl)sulfanyl)4(2chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
prop2enyl6(2(5chloro2methoxyanilino)2oxoethyl)sulfanyl4(2chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
ZINC000101042394
ZINC000101042395
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