Vitas-M small molecule compound
ethyl 5-(2-methoxyphenyl)-1-(3-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK998327
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccccc1OC)c1cccc(c1)C
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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 C22H21N3O5 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5/c1-4-30-22(28)18-17-19(25(23-18)14-9-7-8-13(2)12-14)21(27)24(20(17)26)15-10-5-6-11-16(15)29-3/h5-12,17,19H,4H2,1-3H3InChIKey
ONTWLJTVVSVKPA-UHFFFAOYSA-NSynonyms
1009339-14-31009339143
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=CC=C3OC)C4=CC=CC(=C4)C
ethyl5(2methoxyphenyl)1(3methylphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(2METHOXYPHENYL)1(3METHYLPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
ethyl5(2methoxyphenyl)46dioxo1(mtolyl)13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
InChI=1SC22H21N3O5c143022(28)181719(25(2318)1497813(2)1214)21(27)24(20(17)26)1510561116(15)293h5121719H4H213H3
MFCD03669817
ZINC000005022180
ZINC000100934933
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