Vitas-M small molecule compound
methyl (4Z)-4-(4-{2-[(2-chlorophenyl)amino]-2-oxoethoxy}benzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160067
SMILES COC(=O)C1=C(C)NC(=O)/C/1=C\c1ccc(cc1)OCC(=O)Nc1ccccc1Cl
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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 C22H19ClN2O5 MW 426.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN2O5/c1-13-20(22(28)29-2)16(21(27)24-13)11-14-7-9-15(10-8-14)30-12-19(26)25-18-6-4-3-5-17(18)23/h3-11H,12H2,1-2H3,(H,24,27)(H,25,26)/b16-11-InChIKey
LRYKOCZQMFFIEX-WJDWOHSUSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)OCC(=O)NC3=CC=CC=C3Cl)C(=O)N1)C(=O)OC
COC(=O)C1=C(C)NC(=O)C1=Cc1ccc(cc1)OCC(=O)Nc1ccccc1Cl
InChI=1SC22H19ClN2O5c11320(22(28)292)16(21(27)2413)11147915(10814)301219(26)2518643517(18)23h311H12H212H3(H2427)(H2526)b1611
METHYL(4Z)4((4(2(2CHLOROANILINO)2OXOETHOXY)PHENYL)METHYLIDENE)2METHYL5OXO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4(4(2((2CHLOROPHENYL)AMINO)2OXOETHOXY)BENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD06670333
ZINC000001096998
ZINC01096998
ZINC1096998
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