Vitas-M small molecule compound
methyl 5-(2-methoxyphenyl)-1-(3-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL005601
SMILES COC(=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 C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c1-12-7-6-8-13(11-12)24-18-16(17(22-24)21(27)29-3)19(25)23(20(18)26)14-9-4-5-10-15(14)28-2/h4-11,16,18H,1-3H3InChIKey
ACEPQLXHSXYKNL-UHFFFAOYSA-NSynonyms
958944-14-4958944144
CC1=CC(=CC=C1)N2C3C(C(=N2)C(=O)OC)C(=O)N(C3=O)C4=CC=CC=C4OC
InChI=1SC21H19N3O5c11276813(1112)241816(17(2224)21(27)293)19(25)23(20(18)26)149451015(14)282h4111618H13H3
methyl5(2methoxyphenyl)1(3methylphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(2METHOXYPHENYL)1(3METHYLPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
methyl5(2methoxyphenyl)46dioxo1(mtolyl)13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
MFCD03671476
ZINC000004281906
ZINC000100909577
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