Vitas-M small molecule compound
ethyl 1-acetyl-5-(4-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL222692
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)C)C(=O)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 C17H17N3O5 MW 343.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O5/c1-4-25-17(24)13-12-14(20(18-13)10(3)21)16(23)19(15(12)22)11-7-5-9(2)6-8-11/h5-8,12,14H,4H2,1-3H3InChIKey
BOPVMDNZPVQHKD-UHFFFAOYSA-NSynonyms
499193-31-6499193316
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)C)C(=O)C
ethyl1acetyl46dioxo5(ptolyl)13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ethyl1acetyl5(4methylphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL1ACETYL5(4METHYLPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC17H17N3O5c142517(24)131214(20(1813)10(3)21)16(23)19(15(12)22)11759(2)6811h581214H4H213H3
MFCD02309513
ZINC000017970019
ZINC000101099493
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