Vitas-M small molecule compound
methyl (4Z)-4-{[1-(3,5-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168548
SMILES COCCN1C(=O)/C(=C\c2cc(n(c2C)c2cc(Cl)cc(c2)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 C23H24Cl2N2O4 MW 463.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24Cl2N2O4/c1-13-8-16(14(2)27(13)19-11-17(24)10-18(25)12-19)9-20-21(23(29)31-5)15(3)26(22(20)28)6-7-30-4/h8-12H,6-7H2,1-5H3/b20-9-InChIKey
QPXDTOCXVJQMIU-UKWGHVSLSA-NSynonyms
CC1=CC(=C(N1C2=CC(=CC(=C2)Cl)Cl)C)C=C3C(=C(N(C3=O)CCOC)C)C(=O)OC
COCCN1C(=O)C(=Cc2cc(n(c2C)c2cc(Cl)cc(c2)Cl)C)C(=C1C)C(=O)OC
InChI=1SC23H24Cl2N2O4c113816(14(2)27(13)191117(24)1018(25)1219)92021(23(29)315)15(3)26(22(20)28)67304h812H67H215H3b209
METHYL(4Z)4((1(35DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(35DICHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL4((1(35DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD02951514
ZINC000002185491
ZINC02185491
ZINC2185491
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.