Vitas-M small molecule compound

di-tert-butyl 2,6-dimethyl-4-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK821368
SMILES Cc1ccc(cc1)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 C33H39N3O4 MW 541.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O4/c1-20-15-17-23(18-16-20)29-25(19-36(35-29)24-13-11-10-12-14-24)28-26(30(37)39-32(4,5)6)21(2)34-22(3)27(28)31(38)40-33(7,8)9/h10-19,28,34H,1-9H3
InChIKey
BADSNXKYLUKYOO-UHFFFAOYSA-N
Synonyms

CC1=CC=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
ditertbutyl26dimethyl4(3(4methylphenyl)1phenyl1Hpyrazol4yl)14dihydropyridine35dicarboxylate
DITERTBUTYL26DIMETHYL4(3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC33H39N3O4c120151723(181620)2925(1936(3529)24131110121424)2826(30(37)3932(45)6)21(2)3422(3)27(28)31(38)4033(78)9h10192834H19H3
MFCD03088731
ZINC000100738166
ZINC100738166

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Available files

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