Vitas-M small molecule compound
prop-2-en-1-yl 6-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826201
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)Nc1ccc(c(c1)Cl)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 C27H26ClN3O3S MW 508.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S/c1-5-12-34-27(33)24-18(4)30-26(21(14-29)25(24)19-9-6-16(2)7-10-19)35-15-23(32)31-20-11-8-17(3)22(28)13-20/h5-11,13,25,30H,1,12,15H2,2-4H3,(H,31,32)InChIKey
PRDLVHZSBBMANQ-UHFFFAOYSA-NSynonyms
488717-41-5488717415
allyl6((2((3chloro4methylphenyl)amino)2oxoethyl)thio)5cyano2methyl4(ptolyl)14dihydropyridine3carboxylate
CC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OCC=C)C)SCC(=O)NC3=CC(=C(C=C3)C)Cl)C#N
InChI=1SC27H26ClN3O3Sc15123427(33)2418(4)3026(21(1429)25(24)199616(2)71019)351523(32)312011817(3)22(28)1320h511132530H11215H224H3(H3132)
MFCD03291115
prop2en1yl6((2((3chloro4methylphenyl)amino)2oxoethyl)sulfanyl)5cyano2methyl4(4methylphenyl)14dihydropyridine3carboxylate
PROP2ENYL6(2(3CHLORO4METHYLANILINO)2OXOETHYL)SULFANYL5CYANO2METHYL4(4METHYLPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000020065525
ZINC000020065527
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