Vitas-M small molecule compound
methyl 1-acetyl-5-(3-chlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL003948
SMILES COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1)Cl)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 C15H12ClN3O5 MW 349.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClN3O5/c1-7(20)19-12-10(11(17-19)15(23)24-2)13(21)18(14(12)22)9-5-3-4-8(16)6-9/h3-6,10,12H,1-2H3InChIKey
HAIGKCQMTMCKHU-UHFFFAOYSA-NSynonyms
1009065-54-61009065546
CC(=O)N1C2C(C(=N1)C(=O)OC)C(=O)N(C2=O)C3=CC(=CC=C3)Cl
InChI=1SC15H12ClN3O5c17(20)191210(11(1719)15(23)242)13(21)18(14(12)22)95348(16)69h361012H12H3
methyl1acetyl5(3chlorophenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL1ACETYL5(3CHLOROPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD04178116
ZINC000018168401
ZINC000101135676
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