Vitas-M small molecule compound
methyl (4Z)-4-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-ethyl-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161494
SMILES CCN1C(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)Cl)C)C)/C(=C1C)C(=O)OC
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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 C23H25ClN2O3 MW 412.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O3/c1-7-25-16(5)21(23(28)29-6)19(22(25)27)11-17-10-14(3)26(15(17)4)18-9-8-13(2)20(24)12-18/h8-12H,7H2,1-6H3/b19-11-InChIKey
LMGMTQNRBNCUKX-ODLFYWEKSA-NSynonyms
CCN1C(=C(C(=CC2=C(N(C(=C2)C)C3=CC(=C(C=C3)C)Cl)C)C1=O)C(=O)OC)C
CCN1C(=O)C(=Cc2cc(n(c2C)c2ccc(c(c2)Cl)C)C)C(=C1C)C(=O)OC
InChI=1SC23H25ClN2O3c172516(5)21(23(28)296)19(22(25)27)11171014(3)26(15(17)4)189813(2)20(24)1218h812H7H216H3b1911
METHYL(4Z)4((1(3CHLORO4METHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1ETHYL2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(3CHLORO4METHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1ETHYL2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD03259521
ZINC000003651923
ZINC03651923
ZINC3651923
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