Vitas-M small molecule compound
methyl 1-acetyl-4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL238148
SMILES COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccccc1)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 C15H13N3O5 MW 315.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O5/c1-8(19)18-12-10(11(16-18)15(22)23-2)13(20)17(14(12)21)9-6-4-3-5-7-9/h3-7,10,12H,1-2H3InChIKey
NBIJWBIYEALZSO-UHFFFAOYSA-NSynonyms
1008865-43-71008865437
CC(=O)N1C2C(C(=N1)C(=O)OC)C(=O)N(C2=O)C3=CC=CC=C3
InChI=1SC15H13N3O5c18(19)181210(11(1618)15(22)232)13(20)17(14(12)21)9643579h371012H12H3
methyl1acetyl46dioxo5phenyl13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL1ACETYL46DIOXO5PHENYL3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD04192389
ZINC000005252878
ZINC000101163739
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