Vitas-M small molecule compound

ethyl 1-acetyl-7-(4-ethylphenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate

Catalog ID
STL336747
SMILES CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)CC)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 C19H21N3O5 MW 371.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O5/c1-4-13-6-8-14(9-7-13)21-16(24)11-19(18(21)26)10-15(17(25)27-5-2)20-22(19)12(3)23/h6-9H,4-5,10-11H2,1-3H3
InChIKey
CIMJRGRZEKWBHC-UHFFFAOYSA-N
Synonyms
758686-88-3
758686883
CCC1=CC=C(C=C1)N2C(=O)CC3(C2=O)CC(=NN3C(=O)C)C(=O)OCC
ethyl1acetyl7(4ethylphenyl)68dioxo127triazaspiro(44)non2ene3carboxylate
ETHYL4ACETYL8(4ETHYLPHENYL)79DIOXO348TRIAZASPIRO(44)NON2ENE2CARBOXYLATE
InChI=1SC19H21N3O5c14136814(9713)2116(24)1119(18(21)26)1015(17(25)2752)2022(19)12(3)23h69H451011H213H3
MFCD03668685
ZINC000004995864
ZINC000004995865

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.