Vitas-M small molecule compound
methyl (4Z)-4-(3-chlorobenzylidene)-2-methyl-5-oxo-1-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160040
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cccc(c1)Cl)c1ccc(cc1)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 C23H22ClNO3 MW 395.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO3/c1-14(2)17-8-10-19(11-9-17)25-15(3)21(23(27)28-4)20(22(25)26)13-16-6-5-7-18(24)12-16/h5-14H,1-4H3/b20-13-InChIKey
ICPFKDRZUPSYCJ-MOSHPQCFSA-NSynonyms
CC1=C(C(=CC2=CC(=CC=C2)Cl)C(=O)N1C3=CC=C(C=C3)C(C)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cccc(c1)Cl)c1ccc(cc1)C(C)C
InChI=1SC23H22ClNO3c114(2)1781019(11917)2515(3)21(23(27)284)20(22(25)26)131665718(24)1216h514H14H3b2013
METHYL(4Z)4((3CHLOROPHENYL)METHYLIDENE)2METHYL5OXO1(4PROPAN2YLPHENYL)PYRROLE3CARBOXYLATE
METHYL(4Z)4(3CHLOROBENZYLIDENE)2METHYL5OXO1(4(PROPAN2YL)PHENYL)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01987913
ZINC000004696424
ZINC04696424
ZINC4696424
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