Vitas-M small molecule compound

(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl (2Z)-3-(3-nitrophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoate

Catalog ID
STK382015
SMILES O=C(/C(=C/c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1)OCN1C(=O)c2c(C1=O)cccc2

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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 C25H17N3O7 MW 471.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O7/c29-22(17-8-2-1-3-9-17)26-21(14-16-7-6-10-18(13-16)28(33)34)25(32)35-15-27-23(30)19-11-4-5-12-20(19)24(27)31/h1-14H,15H2,(H,26,29)/b21-14-
InChIKey
YUKIFQVJPDOEAO-STZFKDTASA-N
Synonyms

(13dioxo13dihydro2Hisoindol2yl)methyl(2Z)3(3nitrophenyl)2((phenylcarbonyl)amino)prop2enoate
(13DIOXOBENZO(C)AZOLIDIN2YL)METHYL(2Z)3(3NITROPHENYL)2(PHENYLCARBONYLAMINO)PROP2ENOATE
(13DIOXOISOINDOL2YL)METHYL(Z)2BENZAMIDO3(3NITROPHENYL)PROP2ENOATE
C1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)OCN3C(=O)C4=CC=CC=C4C3=O
InChI=1SC25H17N3O7c2922(178213917)2621(1416761018(1316)28(33)34)25(32)35152723(30)1911451220(19)24(27)31h114H15H2(H2629)b2114
MFCD03037060
O=C(C(=Cc1cccc(c1)(N+)(=O)(O))NC(=O)c1ccccc1)OCN1C(=O)c2c(C1=O)cccc2
ZINC000012655175
ZINC12655175

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Available files

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