Vitas-M small molecule compound
3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-5-(naphthalen-1-yl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Catalog ID
STL055392
SMILES CCOc1cc(cc(c1O)Br)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)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 C29H22BrN3O7 MW 604.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22BrN3O7/c1-2-39-23-14-17(13-21(30)26(23)34)25-24-27(40-32(25)18-9-6-10-19(15-18)33(37)38)29(36)31(28(24)35)22-12-5-8-16-7-3-4-11-20(16)22/h3-15,24-25,27,34H,2H2,1H3InChIKey
GRKVKYDAHGSZLD-UHFFFAOYSA-NSynonyms
1024391-01-21024391012
3(3bromo5ethoxy4hydroxyphenyl)5(naphthalen1yl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(3bromo5ethoxy4hydroxyphenyl)5(naphthalen1yl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
3(3BROMO5ETHOXY4HYDROXYPHENYL)5NAPHTHALEN1YL2(3NITROPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
CCOC1=C(C(=CC(=C1)C2C3C(C(=O)N(C3=O)C4=CC=CC5=CC=CC=C54)ON2C6=CC(=CC=C6)(N+)(=O)(O))Br)O
CCOc1cc(cc(c1O)Br)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC29H22BrN3O7c1239231417(1321(30)26(23)34)252427(4032(25)18961019(1518)33(37)38)29(36)31(28(24)35)221258167341120(16)22h31524252734H2H21H3
MFCD05729701
ZINC000101671139
ZINC000227242192
Check stock
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Check stock on Vitas-MAvailable files
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