Vitas-M small molecule compound
dimethyl 4-(4-{[(2E)-3-(2-chlorophenyl)prop-2-enoyl]oxy}-3-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK821396
SMILES COC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)OC(=O)/C=C/c1ccccc1Cl)C(=O)OC)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 C27H26ClNO7 MW 511.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClNO7/c1-15-23(26(31)34-4)25(24(16(2)29-15)27(32)35-5)18-10-12-20(21(14-18)33-3)36-22(30)13-11-17-8-6-7-9-19(17)28/h6-14,25,29H,1-5H3/b13-11+InChIKey
HJULOCORPYFIMU-ACCUITESSA-NSynonyms
CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=C(C=C2)OC(=O)C=CC3=CC=CC=C3Cl)OC)C(=O)OC
COC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)OC(=O)C=Cc1ccccc1Cl)C(=O)OC)C
dimethyl4(4(((2E)3(2chlorophenyl)prop2enoyl)oxy)3methoxyphenyl)26dimethyl14dihydropyridine35dicarboxylate
dimethyl4(4((E)3(2chlorophenyl)prop2enoyl)oxy3methoxyphenyl)26dimethyl14dihydropyridine35dicarboxylate
InChI=1SC27H26ClNO7c11523(26(31)344)25(24(16(2)2915)27(32)355)18101220(21(1418)333)3622(30)131117867919(17)28h6142529H15H3b1311+
MFCD03462753
ZINC000026964068
ZINC26964068
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