Vitas-M small molecule compound

diethyl 4-(1,3-benzothiazol-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK382575
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1nc2c(s1)cccc2)C(=O)OCC)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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c1-5-25-19(23)15-11(3)21-12(4)16(20(24)26-6-2)17(15)18-22-13-9-7-8-10-14(13)27-18/h7-10,17,21H,5-6H2,1-4H3
InChIKey
HUWOGOQSTHPQKY-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=C(C1C2=NC3=CC=CC=C3S2)C(=O)OCC)C)C
diethyl4(13benzothiazol2yl)26dimethyl14dihydropyridine35dicarboxylate
ETHYL4BENZOTHIAZOL2YL5(ETHOXYCARBONYL)26DIMETHYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC20H22N2O4Sc152519(23)1511(3)2112(4)16(20(24)2662)17(15)1822139781014(13)2718h7101721H56H214H3
MFCD02916286
ZINC000022634386
ZINC22634386

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Available files

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