Vitas-M small molecule compound
methyl 5-(3,4-dimethylphenyl)-6a-methyl-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK710425
SMILES COC(=O)C1=NNC2(C1C(=O)N(C2=O)c1ccc(c(c1)C)C)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 C16H17N3O4 MW 315.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O4/c1-8-5-6-10(7-9(8)2)19-13(20)11-12(14(21)23-4)17-18-16(11,3)15(19)22/h5-7,11,18H,1-4H3InChIKey
YBIPHAVVFCMZLI-UHFFFAOYSA-NSynonyms
342431-53-2342431532
CC1=C(C=C(C=C1)N2C(=O)C3C(=NNC3(C2=O)C)C(=O)OC)C
InChI=1SC16H17N3O4c185610(79(8)2)1913(20)1112(14(21)234)171816(113)15(19)22h571118H14H3
methyl5(34dimethylphenyl)6amethyl46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(34DIMETHYLPHENYL)6AMETHYL46DIOXO13ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD01049399
ZINC000000081710
ZINC000004104476
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