Vitas-M small molecule compound
ethyl (4Z)-4-{[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160448
SMILES COCCN1C(=O)/C(=C\c2cc(n(c2C)c2ccccc2Cl)C)/C(=C1C)C(=O)OCC
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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 C24H27ClN2O4 MW 442.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN2O4/c1-6-31-24(29)22-17(4)26(11-12-30-5)23(28)19(22)14-18-13-15(2)27(16(18)3)21-10-8-7-9-20(21)25/h7-10,13-14H,6,11-12H2,1-5H3/b19-14-InChIKey
GNDJOTGWJMTSFX-RGEXLXHISA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1=CC2=C(N(C(=C2)C)C3=CC=CC=C3Cl)C)CCOC)C
COCCN1C(=O)C(=Cc2cc(n(c2C)c2ccccc2Cl)C)C(=C1C)C(=O)OCC
ETHYL(4Z)4((1(2CHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((1(2CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
InChI=1SC24H27ClN2O4c163124(29)2217(4)26(1112305)23(28)19(22)14181315(2)27(16(18)3)211087920(21)25h7101314H61112H215H3b1914
MFCD03711187
ZINC000014009254
ZINC14009254
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