Vitas-M small molecule compound
methyl (5E)-5-{[1-(2-methoxy-5-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160340
SMILES COC(=O)C1=C(C)N/C(=C/c2cc(n(c2C)c2cc(C)ccc2OC)C)/C1=O
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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 C22H24N2O4 MW 380.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4/c1-12-7-8-19(27-5)18(9-12)24-13(2)10-16(15(24)4)11-17-21(25)20(14(3)23-17)22(26)28-6/h7-11,23H,1-6H3/b17-11+InChIKey
HHFLOSAQDOAIHB-GZTJUZNOSA-NSynonyms
CC1=CC(=C(C=C1)OC)N2C(=CC(=C2C)C=C3C(=O)C(=C(N3)C)C(=O)OC)C
COC(=O)C1=C(C)NC(=Cc2cc(n(c2C)c2cc(C)ccc2OC)C)C1=O
InChI=1SC22H24N2O4c1127819(275)18(912)2413(2)1016(15(24)4)111721(25)20(14(3)2317)22(26)286h71123H16H3b1711+
METHYL(5E)5((1(2METHOXY5METHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(5E)5((1(2METHOXY5METHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
MFCD03922925
ZINC000001106945
ZINC01106945
ZINC1106945
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