Vitas-M small molecule compound
methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxo-4-(4-{2-oxo-2-[(tetrahydrofuran-2-ylmethyl)amino]ethoxy}benzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168515
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)OCC(=O)NCC1CCCO1)CC(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 C25H32N2O6 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O6/c1-16(2)14-27-17(3)23(25(30)31-4)21(24(27)29)12-18-7-9-19(10-8-18)33-15-22(28)26-13-20-6-5-11-32-20/h7-10,12,16,20H,5-6,11,13-15H2,1-4H3,(H,26,28)/b21-12-InChIKey
SHDBUEASFZJNBD-MTJSOVHGSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)OCC(=O)NCC3CCCO3)C(=O)N1CC(C)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)OCC(=O)NCC1CCCO1)CC(C)C
InChI=1SC25H32N2O6c116(2)142717(3)23(25(30)314)21(24(27)29)12187919(10818)331522(28)26132065113220h710121620H56111315H214H3(H2628)b2112
METHYL(4Z)2METHYL1(2METHYLPROPYL)5OXO4((4(2OXO2(OXOLAN2YLMETHYLAMINO)ETHOXY)PHENYL)METHYLIDENE)PYRROLE3CARBOXYLATE
METHYL(4Z)2METHYL1(2METHYLPROPYL)5OXO4(4(2OXO2((TETRAHYDROFURAN2YLMETHYL)AMINO)ETHOXY)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL5METHYL1(2METHYLPROPYL)2OXO3((4((N(OXOLAN2YLMETHYL)CARBAMOYL)METHOXY)PHENYL)METHYLENE)AZOLINE4CARBOXYLATE
MFCD03042487
ZINC000000832471
ZINC000006232851
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.