Vitas-M small molecule compound
(4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-nitrophenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Catalog ID
STL046200
SMILES CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCc1ccccc1)/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 C28H24N2O6 MW 484.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O6/c1-17-14-21-15-20(10-11-23(21)36-17)26(31)24-25(19-8-5-9-22(16-19)30(34)35)29(28(33)27(24)32)13-12-18-6-3-2-4-7-18/h2-11,15-17,25,31H,12-14H2,1H3/b26-24+InChIKey
YSFDPQXHCHHDSC-SHHOIMCASA-NSynonyms
(4E)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(3nitrophenyl)1(2phenylethyl)pyrrolidine23dione
(4E)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(3NITROPHENYL)1PHENETHYLPYRROLIDINE23DIONE
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CCC4=CC=CC=C4)C5=CC(=CC=C5)(N+)(=O)(O))O
CC1Oc2c(C1)cc(cc2)C(=C1C(=O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))CCc1ccccc1)O
InChI=1SC28H24N2O6c11714211520(101123(21)3617)26(31)2425(1985922(1619)30(34)35)29(28(33)27(24)32)1312186324718h21115172531H1214H21H3b2624+
MFCD04081135
ZINC000102736944
ZINC000102736958
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