Vitas-M small molecule compound
ethyl 5-(2-chlorophenyl)-4,6-dioxo-1-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK865571
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccccc1Cl)c1ccccc1
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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 C20H16ClN3O4 MW 397.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O4/c1-2-28-20(27)16-15-17(24(22-16)12-8-4-3-5-9-12)19(26)23(18(15)25)14-11-7-6-10-13(14)21/h3-11,15,17H,2H2,1H3InChIKey
HSVKCNAZNOMLDI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=CC=C3Cl)C4=CC=CC=C4
ethyl5(2chlorophenyl)46dioxo1phenyl13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(2CHLOROPHENYL)46DIOXO1PHENYL3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
ETHYL5(2CHLOROPHENYL)46DIOXO3PHENYL353A6ATETRAHYDRO235TRIAZAPENTALENECARBOXYLATE
InChI=1SC20H16ClN3O4c122820(27)161517(24(2216)128435912)19(26)23(18(15)25)1411761013(14)21h3111517H2H21H3
MFCD02235936
ZINC000004862899
ZINC000100563693
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