Vitas-M small molecule compound
ethyl 4-{[2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoyl]amino}benzoate
Catalog ID
STK257937
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C(N1C(=O)C2C(C1=O)C1CC2C=C1)Cc1ccccc1
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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 C27H26N2O5 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5/c1-2-34-27(33)17-10-12-20(13-11-17)28-24(30)21(14-16-6-4-3-5-7-16)29-25(31)22-18-8-9-19(15-18)23(22)26(29)32/h3-13,18-19,21-23H,2,14-15H2,1H3,(H,28,30)InChIKey
WSEYQMGIBDTHNH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5CC(C4C3=O)C=C5
ETHYL4((2(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)3PHENYLPROPANOYL)AMINO)BENZOATE
InChI=1SC27H26N2O5c123427(33)17101220(131117)2824(30)21(14166435716)2925(31)22188919(1518)23(22)26(29)32h31318192123H21415H21H3(H2830)
MFCD03185448
ZINC000101317853
ZINC000239235788
Check stock
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Check stock on Vitas-MAvailable files
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