Vitas-M small molecule compound
ethyl 1-acetyl-5-(4-ethoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL240937
SMILES CCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2C(=O)C)C(=O)OCC
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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 C18H19N3O6 MW 373.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O6/c1-4-26-12-8-6-11(7-9-12)20-16(23)13-14(18(25)27-5-2)19-21(10(3)22)15(13)17(20)24/h6-9,13,15H,4-5H2,1-3H3InChIKey
MSCKYIVSYZPZJI-UHFFFAOYSA-NSynonyms
1008407-05-31008407053
CCOC1=CC=C(C=C1)N2C(=O)C3C(C2=O)N(N=C3C(=O)OCC)C(=O)C
ethyl1acetyl5(4ethoxyphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL1ACETYL5(4ETHOXYPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC18H19N3O6c1426128611(7912)2016(23)1314(18(25)2752)1921(10(3)22)15(13)17(20)24h691315H45H213H3
MFCD04192136
ZINC000005252598
ZINC000101163416
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