Vitas-M small molecule compound
2-(2-methoxyethyl)-3-oxo-2,3,4,5,6,7-hexahydro-1H-isoindol-1-yl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate
Catalog ID
STK031005
SMILES COCCN1C(OC(=O)c2c(nn(c2C)c2ccccc2)c2ccccc2)C2=C(C1=O)CCCC2
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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 C28H29N3O4 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4/c1-19-24(25(20-11-5-3-6-12-20)29-31(19)21-13-7-4-8-14-21)28(33)35-27-23-16-10-9-15-22(23)26(32)30(27)17-18-34-2/h3-8,11-14,27H,9-10,15-18H2,1-2H3InChIKey
AAYISANEPDXWHI-UHFFFAOYSA-NSynonyms
(2(2methoxyethyl)3oxo4567tetrahydro1Hisoindol1yl)5methyl13diphenylpyrazole4carboxylate
2(2methoxyethyl)3oxo234567hexahydro1Hisoindol1yl5methyl13diphenyl1Hpyrazole4carboxylate
CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC4C5=C(CCCC5)C(=O)N4CCOC
COCCN1C(OC(=O)c2c(nn(c2C)c2ccccc2)c2ccccc2)C2=C(C1=O)CCCC2
InChI=1SC28H29N3O4c11924(25(20115361220)2931(19)21137481421)28(33)352723161091522(23)26(32)30(27)1718342h38111427H9101518H212H3
MFCD11850984
STK031005
ZINC000023343447
ZINC000023343450
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