Vitas-M small molecule compound

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

Catalog ID
STK402774
SMILES COC(=O)C1=CN(C=C(C1c1cscc1)C(=O)OC)C1CC1

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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 C16H17NO4S MW 319.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO4S/c1-20-15(18)12-7-17(11-3-4-11)8-13(16(19)21-2)14(12)10-5-6-22-9-10/h5-9,11,14H,3-4H2,1-2H3
InChIKey
OFWKPTZQUNBDQT-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C(C1C2=CSC=C2)C(=O)OC)C3CC3
DIMETHYL1CYCLOPROPYL4(3THIENYL)14DIHYDRO35PYRIDINEDICARBOXYLATE
DIMETHYL1CYCLOPROPYL4(3THIENYL)14DIHYDROPYRIDINE35DICARBOXYLATE
dimethyl1cyclopropyl4(thiophen3yl)14dihydropyridine35dicarboxylate
DIMETHYL1CYCLOPROPYL4THIOPHEN3YL4HPYRIDINE35DICARBOXYLATE
InChI=1SC16H17NO4Sc12015(18)12717(113411)813(16(19)212)14(12)105622910h591114H34H212H3
MFCD02868479
ZINC000000091728
ZINC00091728
ZINC91728

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Available files

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