Vitas-M small molecule compound
methyl (4Z)-2-methyl-5-oxo-4-(4-{2-oxo-2-[(tetrahydrofuran-2-ylmethyl)amino]ethoxy}benzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168514
SMILES COC(=O)C1=C(C)NC(=O)/C/1=C\c1ccc(cc1)OCC(=O)NCC1CCCO1
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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 C21H24N2O6 MW 400.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O6/c1-13-19(21(26)27-2)17(20(25)23-13)10-14-5-7-15(8-6-14)29-12-18(24)22-11-16-4-3-9-28-16/h5-8,10,16H,3-4,9,11-12H2,1-2H3,(H,22,24)(H,23,25)/b17-10-InChIKey
OZDMVEDVSJAEFH-YVLHZVERSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)OCC(=O)NCC3CCCO3)C(=O)N1)C(=O)OC
COC(=O)C1=C(C)NC(=O)C1=Cc1ccc(cc1)OCC(=O)NCC1CCCO1
InChI=1SC21H24N2O6c11319(21(26)272)17(20(25)2313)10145715(8614)291218(24)2211164392816h581016H3491112H212H3(H2224)(H2325)b1710
METHYL(4Z)2METHYL5OXO4((4(2OXO2(OXOLAN2YLMETHYLAMINO)ETHOXY)PHENYL)METHYLIDENE)1HPYRROLE3CARBOXYLATE
METHYL(4Z)2METHYL5OXO4(4(2OXO2((TETRAHYDROFURAN2YLMETHYL)AMINO)ETHOXY)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03235393
ZINC000004703020
ZINC000004703021
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