Vitas-M small molecule compound
4-chloro-2-({[1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)benzoic acid
Catalog ID
STK035837
SMILES Clc1ccc(c(c1)NC(=O)c1ccc2c(c1)C(=O)N(C2=O)CC1CCCO1)C(=O)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 C21H17ClN2O6 MW 428.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O6/c22-12-4-6-15(21(28)29)17(9-12)23-18(25)11-3-5-14-16(8-11)20(27)24(19(14)26)10-13-2-1-7-30-13/h3-6,8-9,13H,1-2,7,10H2,(H,23,25)(H,28,29)InChIKey
ORUAWVDHVLQKIB-UHFFFAOYSA-NSynonyms
4CHLORO2(((13DIOXO2(TETRAHYDROFURAN2YLMETHYL)23DIHYDRO1HISOINDOL5YL)CARBONYL)AMINO)BENZOICACID
4CHLORO2((13DIOXO2(OXOLAN2YLMETHYL)ISOINDOLE5CARBONYL)AMINO)BENZOICACID
C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=CC(=C4)Cl)C(=O)O
Clc1ccc(c(c1)NC(=O)c1ccc2c(c1)C(=O)N(C2=O)CC1CCCO1)C(=O)O
InChI=1SC21H17ClN2O6c22124615(21(28)29)17(912)2318(25)11351416(811)20(27)24(19(14)26)10132173013h368913H12710H2(H2325)(H2829)
MFCD01974106
STK035837
ZINC000013186678
ZINC000013186681
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