Vitas-M small molecule compound
2-{[(3-{5-[(2-carboxyphenyl)carbamoyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}phenyl)carbonyl]amino}benzoic acid
Catalog ID
STK156643
SMILES O=C1N(c2cccc(c2)C(=O)Nc2ccccc2C(=O)O)C(=O)c2c1ccc(c2)C(=O)Nc1ccccc1C(=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 C30H19N3O8 MW 549.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H19N3O8/c34-25(31-23-10-3-1-8-20(23)29(38)39)16-6-5-7-18(14-16)33-27(36)19-13-12-17(15-22(19)28(33)37)26(35)32-24-11-4-2-9-21(24)30(40)41/h1-15H,(H,31,34)(H,32,35)(H,38,39)(H,40,41)InChIKey
YLXMICZGNGWNNK-UHFFFAOYSA-NSynonyms
2(((3(5((2CARBOXYPHENYL)CARBAMOYL)13DIOXO13DIHYDRO2HISOINDOL2YL)PHENYL)CARBONYL)AMINO)BENZOICACID
2((3(5((2CARBOXYPHENYL)CARBAMOYL)13DIOXOISOINDOL2YL)BENZOYL)AMINO)BENZOICACID
C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NC5=CC=CC=C5C(=O)O
InChI=1SC30H19N3O8c3425(31231031820(23)29(38)39)1665718(1416)3327(36)19131217(1522(19)28(33)37)26(35)32241142921(24)30(40)41h115H(H3134)(H3235)(H3839)(H4041)
MFCD00304988
ZINC000003142016
ZINC3142016
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