Vitas-M small molecule compound
5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[3-(phenylcarbonyl)phenyl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK083824
SMILES O=C(c1ccccc1)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)c1nc2ccccc2c(=O)o1
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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 C29H16N2O5 MW 472.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H16N2O5/c32-25(17-7-2-1-3-8-17)18-9-6-10-20(15-18)31-27(33)21-14-13-19(16-23(21)28(31)34)26-30-24-12-5-4-11-22(24)29(35)36-26/h1-16HInChIKey
TZSUCCWXJIHYJT-UHFFFAOYSA-NSynonyms
2(3BENZOYLPHENYL)5(4OXO31BENZOXAZIN2YL)ISOINDOLE13DIONE
5(4OXO4H31BENZOXAZIN2YL)2(3(PHENYLCARBONYL)PHENYL)1HISOINDOLE13(2H)DIONE
C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C5=NC6=CC=CC=C6C(=O)O5
InChI=1SC29H16N2O5c3225(177213817)18961020(1518)3127(33)21141319(1623(21)28(31)34)26302412541122(24)29(35)3626h116H
MFCD03624338
O=C(c1ccccc1)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)c1nc2ccccc2c(=O)o1
STK083824
ZINC000009678956
ZINC09678956
ZINC9678956
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