Vitas-M small molecule compound

3-(4-butoxy-3-methoxyphenyl)-5-(4-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STL048088
SMILES CCCCOc1ccc(cc1OC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])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 C28H27N3O7 MW 517.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O7/c1-3-4-16-37-22-15-10-18(17-23(22)36-2)25-24-26(38-30(25)20-8-6-5-7-9-20)28(33)29(27(24)32)19-11-13-21(14-12-19)31(34)35/h5-15,17,24-26H,3-4,16H2,1-2H3
InChIKey
RXTZBZXMDAUWOR-UHFFFAOYSA-N
Synonyms
1023033-11-5
1023033115
3(4BUTOXY3METHOXYPHENYL)5(4NITROPHENYL)2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3(4butoxy3methoxyphenyl)5(4nitrophenyl)2phenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(4butoxy3methoxyphenyl)5(4nitrophenyl)2phenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CCCCOC1=C(C=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))ON2C5=CC=CC=C5)OC
CCCCOc1ccc(cc1OC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
InChI=1SC28H27N3O7c134163722151018(1723(22)362)252426(3830(25)208657920)28(33)29(27(24)32)19111321(141219)31(34)35h515172426H3416H212H3
MFCD04164510
ZINC000013768540
ZINC000137826674

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Available files

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