Vitas-M small molecule compound
(3aS,6aR)-5-(naphthalen-1-yl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STK617544
SMILES O=C1[C@@H]2ON=C([C@@H]2C(=O)N1c1cccc2c1cccc2)c1c(C)nn(c1C)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 C21H18N4O3 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3/c1-11-16(12(2)24(3)22-11)18-17-19(28-23-18)21(27)25(20(17)26)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,17,19H,1-3H3/t17-,19+/m0/s1InChIKey
UUTNWJCMCGSHLL-PKOBYXMFSA-NSynonyms
956145-13-4(3aS6aR)5(naphthalen1yl)3(135trimethyl1Hpyrazol4yl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3aS6aR)5(naphthalen1yl)3(135trimethyl1Hpyrazol4yl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
(3aS6aR)5naphthalen1yl3(135trimethylpyrazol4yl)3a6adihydropyrrolo(34d)(12)oxazole46dione
956145134
CC1=C(C(=NN1C)C)C2=NOC3C2C(=O)N(C3=O)C4=CC=CC5=CC=CC=C54
InChI=1SC21H18N4O3c11116(12(2)24(3)2211)181719(282318)21(27)25(20(17)26)15106813745914(13)15h4101719H13H3t1719+m0s1
MFCD18246346
O=C1(C@@H)2ON=C((C@@H)2C(=O)N1c1cccc2c1cccc2)c1c(C)nn(c1C)C
ZINC000101466704
ZINC101466704
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