Vitas-M small molecule compound
ethyl (4Z)-4-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK092987
SMILES COCCN1C(=O)/C(=C\c2cc(n(c2C)c2cccc(c2)C)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 C25H30N2O4 MW 422.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O4/c1-7-31-25(29)23-19(5)26(11-12-30-6)24(28)22(23)15-20-14-17(3)27(18(20)4)21-10-8-9-16(2)13-21/h8-10,13-15H,7,11-12H2,1-6H3/b22-15-InChIKey
WLQIGWHYICRJAN-JCMHNJIXSA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1=CC2=C(N(C(=C2)C)C3=CC=CC(=C3)C)C)CCOC)C
COCCN1C(=O)C(=Cc2cc(n(c2C)c2cccc(c2)C)C)C(=C1C)C(=O)OCC
ETHYL(4Z)4((25DIMETHYL1(3METHYLPHENYL)1HPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((25DIMETHYL1(3METHYLPHENYL)PYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
InChI=1SC25H30N2O4c173125(29)2319(5)26(1112306)24(28)22(23)15201417(3)27(18(20)4)21108916(2)1321h8101315H71112H216H3b2215
MFCD03259040
STK092987
ZINC000013895103
ZINC13895103
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