Vitas-M small molecule compound
methyl (4Z)-4-(4-{2-[(2-chlorophenyl)amino]-2-oxoethoxy}benzylidene)-2-methyl-5-oxo-1-(propan-2-yl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK169267
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)OCC(=O)Nc1ccccc1Cl)C(C)C
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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 C25H25ClN2O5 MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O5/c1-15(2)28-16(3)23(25(31)32-4)19(24(28)30)13-17-9-11-18(12-10-17)33-14-22(29)27-21-8-6-5-7-20(21)26/h5-13,15H,14H2,1-4H3,(H,27,29)/b19-13-InChIKey
BGBBHXAZGCYGSZ-UYRXBGFRSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)OCC(=O)NC3=CC=CC=C3Cl)C(=O)N1C(C)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)OCC(=O)Nc1ccccc1Cl)C(C)C
InChI=1SC25H25ClN2O5c115(2)2816(3)23(25(31)324)19(24(28)30)131791118(121017)331422(29)2721865720(21)26h51315H14H214H3(H2729)b1913
METHYL(4Z)4((4(2(2CHLOROANILINO)2OXOETHOXY)PHENYL)METHYLIDENE)2METHYL5OXO1PROPAN2YLPYRROLE3CARBOXYLATE
METHYL(4Z)4(4(2((2CHLOROPHENYL)AMINO)2OXOETHOXY)BENZYLIDENE)2METHYL5OXO1(PROPAN2YL)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL3((4((N(2CHLOROPHENYL)CARBAMOYL)METHOXY)PHENYL)METHYLENE)5METHYL1(METHYLETHYL)2OXOAZOLINE4CARBOXYLATE
MFCD01964290
ZINC000009846980
ZINC09846980
ZINC9846980
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