Vitas-M small molecule compound
1-(2,5-dimethylbenzyl)-3-hydroxy-3-[2-(4-nitrophenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK272787
SMILES Cc1ccc(c(c1)CN1c2ccccc2C(C1=O)(O)CC(=O)c1ccc(cc1)[N+](=O)[O-])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 C25H22N2O5 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5/c1-16-7-8-17(2)19(13-16)15-26-22-6-4-3-5-21(22)25(30,24(26)29)14-23(28)18-9-11-20(12-10-18)27(31)32/h3-13,30H,14-15H2,1-2H3InChIKey
UXRMGQNURNNTDE-UHFFFAOYSA-NSynonyms
1((25DIMETHYLPHENYL)METHYL)3HYDROXY3(2(4NITROPHENYL)2OXOETHYL)INDOL2ONE
1((25DIMETHYLPHENYL)METHYL)3HYDROXY3(2(4NITROPHENYL)2OXOETHYL)INDOLIN2ONE
1(25dimethylbenzyl)3hydroxy3(2(4nitrophenyl)2oxoethyl)13dihydro2Hindol2one
CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC=C(C=C4)(N+)(=O)(O))O
Cc1ccc(c(c1)CN1c2ccccc2C(C1=O)(O)CC(=O)c1ccc(cc1)(N+)(=O)(O))C
InChI=1SC25H22N2O5c1167817(2)19(1316)152622643521(22)25(3024(26)29)1423(28)1891120(121018)27(31)32h31330H1415H212H3
MFCD04042339
ZINC000008927821
ZINC000008927822
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