Vitas-M small molecule compound
methyl (4Z)-4-{[1-(4-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
STK160888
SMILES COCCN1C(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2)Cl)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 C23H25ClN2O4 MW 428.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O4/c1-14-12-17(15(2)26(14)19-8-6-18(24)7-9-19)13-20-21(23(28)30-5)16(3)25(22(20)27)10-11-29-4/h6-9,12-13H,10-11H2,1-5H3/b20-13-InChIKey
UNNSOUOVQGTTRC-MOSHPQCFSA-NSynonyms
CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=C3C(=C(N(C3=O)CCOC)C)C(=O)OC
COCCN1C(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)Cl)C)C(=C1C)C(=O)OC
InChI=1SC23H25ClN2O4c1141217(15(2)26(14)198618(24)7919)132021(23(28)305)16(3)25(22(20)27)1011294h691213H1011H215H3b2013
METHYL(4Z)4((1(4CHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(4CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD03922843
ZINC000008872521
ZINC08872521
ZINC8872521
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