Vitas-M small molecule compound
dibenzyl 4-[3-(4-butoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK810692
SMILES CCCCOc1ccc(c(c1)C)c1nn(cc1C1C(=C(C)NC(=C1C(=O)OCc1ccccc1)C)C(=O)OCc1ccccc1)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 C43H43N3O5 MW 681.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H43N3O5/c1-5-6-24-49-35-22-23-36(29(2)25-35)41-37(26-46(45-41)34-20-14-9-15-21-34)40-38(42(47)50-27-32-16-10-7-11-17-32)30(3)44-31(4)39(40)43(48)51-28-33-18-12-8-13-19-33/h7-23,25-26,40,44H,5-6,24,27-28H2,1-4H3InChIKey
QSLHRSRCAPNKHJ-UHFFFAOYSA-NSynonyms
CCCCOC1=CC(=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OCC4=CC=CC=C4)C)C)C(=O)OCC5=CC=CC=C5)C6=CC=CC=C6)C
dibenzyl4(3(4butoxy2methylphenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
DIBENZYL4(3(4BUTOXY2METHYLPHENYL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC43H43N3O5c156244935222336(29(2)2535)4137(2646(4541)3420149152134)4038(42(47)50273216107111732)30(3)4431(4)39(40)43(48)51283318128131933h72325264044H56242728H214H3
MFCD04500560
ZINC000098047096
ZINC98047096
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