Vitas-M small molecule compound
(3aR,6aS)-5-(naphthalen-2-yl)-3-(3-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STK551382
SMILES O=C1N(c2ccc3c(c2)cccc3)C(=O)[C@@H]2[C@H]1C(=NO2)c1cccc(c1)[N+](=O)[O-]
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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 C21H13N3O5 MW 387.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N3O5/c25-20-17-18(14-6-3-7-16(11-14)24(27)28)22-29-19(17)21(26)23(20)15-9-8-12-4-1-2-5-13(12)10-15/h1-11,17,19H/t17-,19+/m1/s1InChIKey
PYDDQXICUXKDFK-MJGOQNOKSA-NSynonyms
1212066-83-5(3aR6aS)5(naphthalen2yl)3(3nitrophenyl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3aR6aS)5(naphthalen2yl)3(3nitrophenyl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
(3AR6AS)5NAPHTHALEN2YL3(3NITROPHENYL)3A6ADIHYDROPYRROLO(34D)(12)OXAZOLE46DIONE
1212066835
C1=CC=C2C=C(C=CC2=C1)N3C(=O)C4C(C3=O)ON=C4C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC21H13N3O5c25201718(1463716(1114)24(27)28)222919(17)21(26)23(20)159812412513(12)1015h1111719Ht1719+m1s1
MFCD18242585
O=C1N(c2ccc3c(c2)cccc3)C(=O)(C@@H)2(C@H)1C(=NO2)c1cccc(c1)(N+)(=O)(O)
ZINC000101012321
ZINC101012321
Check stock
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Check stock on Vitas-MAvailable files
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