Vitas-M small molecule compound
dimethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK407131
SMILES COC(=O)C1=CN(Cc2cccs2)C=C(C1c1cc(Cl)c(c(c1)OC)O)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 C21H20ClNO6S MW 449.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClNO6S/c1-27-17-8-12(7-16(22)19(17)24)18-14(20(25)28-2)10-23(9-13-5-4-6-30-13)11-15(18)21(26)29-3/h4-8,10-11,18,24H,9H2,1-3H3InChIKey
HJPDVZAGQSPUJU-UHFFFAOYSA-NSynonyms
COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC=CS3)C(=O)OC)Cl)O
dimethyl4(3chloro4hydroxy5methoxyphenyl)1(thiophen2ylmethyl)14dihydropyridine35dicarboxylate
DIMETHYL4(3CHLORO4HYDROXY5METHOXYPHENYL)1(THIOPHEN2YLMETHYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC21H20ClNO6Sc12717812(716(22)19(17)24)1814(20(25)282)1023(9135463013)1115(18)21(26)293h4810111824H9H213H3
METHYL4(3CHLORO4HYDROXY5METHOXYPHENYL)5(METHOXYCARBONYL)1(2THIENYLMETHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD06628241
ZINC000002881067
ZINC02881067
ZINC2881067
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