Vitas-M small molecule compound
di-tert-butyl 4-[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK812006
SMILES CCCCOc1ccc(cc1C)c1nn(cc1C1C(=C(C)NC(=C1C(=O)OC(C)(C)C)C)C(=O)OC(C)(C)C)c1ccccc1
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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 C37H47N3O5 MW 613.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H47N3O5/c1-11-12-20-43-29-19-18-26(21-23(29)2)33-28(22-40(39-33)27-16-14-13-15-17-27)32-30(34(41)44-36(5,6)7)24(3)38-25(4)31(32)35(42)45-37(8,9)10/h13-19,21-22,32,38H,11-12,20H2,1-10H3InChIKey
SIKDEFTUWANFMF-UHFFFAOYSA-NSynonyms
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OC(C)(C)C)C)C)C(=O)OC(C)(C)C)C4=CC=CC=C4)C
ditertbutyl4(3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
DITERTBUTYL4(3(4BUTOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC37H47N3O5c11112204329191826(2123(29)2)3328(2240(3933)27161413151727)3230(34(41)4436(56)7)24(3)3825(4)31(32)35(42)4537(89)10h131921223238H111220H2110H3
MFCD06264955
ZINC000098046344
ZINC98046344
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