Vitas-M small molecule compound

dimethyl 1-(3,4-dimethoxybenzyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK036079
SMILES COC(=O)C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1cccs1)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 C22H23NO6S MW 429.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO6S/c1-26-17-8-7-14(10-18(17)27-2)11-23-12-15(21(24)28-3)20(19-6-5-9-30-19)16(13-23)22(25)29-4/h5-10,12-13,20H,11H2,1-4H3
InChIKey
ABELRIIRVNKAGM-UHFFFAOYSA-N
Synonyms

1((34DIMETHOXYPHENYL)METHYL)4THIOPHEN2YL4HPYRIDINE35DICARBOXYLICACIDDIMETHYLESTER
4(2THIENYL)1VERATRYL4HPYRIDINE35DICARBOXYLICACIDDIMETHYLESTER
COC(=O)C1=CN(Cc2ccc(c(c2)OC)OC)C=C(C1c1cccs1)C(=O)OC
COC1=C(C=C(C=C1)CN2C=C(C(C(=C2)C(=O)OC)C3=CC=CS3)C(=O)OC)OC
DIMETHYL1((34DIMETHOXYPHENYL)METHYL)4THIOPHEN2YL4HPYRIDINE35DICARBOXYLATE
DIMETHYL1(34DIMETHOXYBENZYL)4(THIOPHEN2YL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC22H23NO6Sc126178714(1018(17)272)11231215(21(24)283)20(196593019)16(1323)22(25)294h510121320H11H214H3
METHYL1((34DIMETHOXYPHENYL)METHYL)5(METHOXYCARBONYL)4(2THIENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02188798
STK036079
ZINC000001087776
ZINC01087776
ZINC1087776

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Available files

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