Vitas-M small molecule compound
(3aS,6aS)-5-(3-methoxyphenyl)-3-(quinolin-2-ylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Catalog ID
STL534165
SMILES COc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)NN=C2C(=O)c1ccc2c(n1)cccc2
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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 C22H16N4O4 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O4/c1-30-14-7-4-6-13(11-14)26-21(28)17-18(24-25-19(17)22(26)29)20(27)16-10-9-12-5-2-3-8-15(12)23-16/h2-11,17,19,25H,1H3/t17-,19+/m1/s1InChIKey
HUNBPMYMZFXCKK-MJGOQNOKSA-NSynonyms
312964-69-5(3~(a)~(S)6~(a)~(S))5(3methoxyphenyl)3(quinoline2carbonyl)3~(a)6~(a)dihydro1~(H)pyrrolo(34c)pyrazole46dione
(3aS6aS)5(3methoxyphenyl)3(quinolin2ylcarbonyl)3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
(3aS6aS)5(3methoxyphenyl)3(quinoline2carbonyl)16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
(3AS6AS)5(3METHOXYPHENYL)3(QUINOLINE2CARBONYL)3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE46DIONE
312964695
7074809
COc1cccc(c1)N1C(=O)(C@H)2(C@@H)(C1=O)NN=C2C(=O)c1ccc2c(n1)cccc2
InChI=1SC22H16N4O4c1301474613(1114)2621(28)1718(242519(17)22(26)29)20(27)1610912523815(12)2316h211171925H1H3t1719+m1s1
MFCD01081600
ZINC000017920729
ZINC17920729
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