Vitas-M small molecule compound
dimethyl 4-{3-[4-(butylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK800671
SMILES CCCCSc1ccc(cc1)c1nn(cc1C1C(=C(C)NC(=C1C(=O)OC)C)C(=O)OC)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 C30H33N3O4S MW 531.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N3O4S/c1-6-7-17-38-23-15-13-21(14-16-23)28-24(18-33(32-28)22-11-9-8-10-12-22)27-25(29(34)36-4)19(2)31-20(3)26(27)30(35)37-5/h8-16,18,27,31H,6-7,17H2,1-5H3InChIKey
DASIHQPYDLAVQR-UHFFFAOYSA-NSynonyms
CCCCSC1=CC=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OC)C)C)C(=O)OC)C4=CC=CC=C4
dimethyl4(3(4(butylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
dimethyl4(3(4butylsulfanylphenyl)1phenylpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
InChI=1SC30H33N3O4Sc167173823151321(141623)2824(1833(3228)221198101222)2725(29(34)364)19(2)3120(3)26(27)30(35)375h816182731H6717H215H3
MFCD03686446
ZINC000024334356
ZINC24334356
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