Vitas-M small molecule compound
4-[3-(diphenylacetyl)-4,6-dioxo-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzonitrile
Catalog ID
STL308737
SMILES N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2)C(=O)C(c1ccccc1)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 C26H18N4O3 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N4O3/c27-15-16-11-13-19(14-12-16)30-25(32)21-22(28-29-23(21)26(30)33)24(31)20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,20-21,23,29HInChIKey
FQMOLCNZCLNJKB-UHFFFAOYSA-NSynonyms
4((3aS6aS)3(22diphenylacetyl)46dioxo3a466atetrahydropyrrolo(34c)pyrazol5(1H)yl)benzonitrile
4(3(22DIPHENYLACETYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOL5YL)BENZONITRILE
4(3(diphenylacetyl)46dioxo3a466atetrahydropyrrolo(34c)pyrazol5(1H)yl)benzonitrile
C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)C3=NNC4C3C(=O)N(C4=O)C5=CC=C(C=C5)C#N
InChI=1SC26H18N4O3c271516111319(141216)3025(32)2122(282923(21)26(30)33)24(31)20(177314817)1895261018h11420212329H
MFCD05735016
N#Cc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)C(=NN2)C(=O)C(c1ccccc1)c1ccccc1
ZINC000009411194
ZINC000103544567
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