Vitas-M small molecule compound
dimethyl 2,6-dimethyl-4-{1-phenyl-3-[4-(prop-2-en-1-yloxy)phenyl]-1H-pyrazol-4-yl}-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK812010
SMILES COC(=O)C1=C(C)NC(=C(C1c1cn(nc1c1ccc(cc1)OCC=C)c1ccccc1)C(=O)OC)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 C29H29N3O5 MW 499.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O5/c1-6-16-37-22-14-12-20(13-15-22)27-23(17-32(31-27)21-10-8-7-9-11-21)26-24(28(33)35-4)18(2)30-19(3)25(26)29(34)36-5/h6-15,17,26,30H,1,16H2,2-5H3InChIKey
BMUURLQMXVFMBV-UHFFFAOYSA-NSynonyms
956625-33-5956625335
CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CN(N=C2C3=CC=C(C=C3)OCC=C)C4=CC=CC=C4)C(=O)OC
dimethyl26dimethyl4(1phenyl3(4(prop2en1yloxy)phenyl)1Hpyrazol4yl)14dihydropyridine35dicarboxylate
DIMETHYL26DIMETHYL4(1PHENYL3(4PROP2ENOXYPHENYL)PYRAZOL4YL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC29H29N3O5c16163722141220(131522)2723(1732(3127)21108791121)2624(28(33)354)18(2)3019(3)25(26)29(34)365h615172630H116H225H3
MFCD04445777
ZINC000024334129
ZINC24334129
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