Vitas-M small molecule compound

dimethyl 1-(4-methylbenzyl)-4-(5-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK066362
SMILES COC(=O)C1=CN(Cc2ccc(cc2)C)C=C(C1c1ccc(s1)C)C(=O)OC

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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 C22H23NO4S MW 397.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4S/c1-14-5-8-16(9-6-14)11-23-12-17(21(24)26-3)20(18(13-23)22(25)27-4)19-10-7-15(2)28-19/h5-10,12-13,20H,11H2,1-4H3
InChIKey
YMYNYDRANYPXHK-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)CN2C=C(C(C(=C2)C(=O)OC)C3=CC=C(S3)C)C(=O)OC
COC(=O)C1=CN(Cc2ccc(cc2)C)C=C(C1c1ccc(s1)C)C(=O)OC
DIMETHYL1((4METHYLPHENYL)METHYL)4(5METHYLTHIOPHEN2YL)4HPYRIDINE35DICARBOXYLATE
DIMETHYL1(4METHYLBENZYL)4(5METHYLTHIOPHEN2YL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC22H23NO4Sc1145816(9614)11231217(21(24)263)20(18(1323)22(25)274)1910715(2)2819h510121320H11H214H3
METHYL5(METHOXYCARBONYL)4(5METHYL(2THIENYL))1((4METHYLPHENYL)METHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02105414
STK066362
ZINC000000720102
ZINC00720102
ZINC720102

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.