Vitas-M small molecule compound
methyl (4Z)-4-{[1-(3-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-ethyl-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160445
SMILES CCN1C(=O)/C(=C\c2cc(n(c2C)c2cccc(c2)Br)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 C22H23BrN2O3 MW 443.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O3/c1-6-24-15(4)20(22(27)28-5)19(21(24)26)11-16-10-13(2)25(14(16)3)18-9-7-8-17(23)12-18/h7-12H,6H2,1-5H3/b19-11-InChIKey
HVJPPOGVQJQDKV-ODLFYWEKSA-NSynonyms
CCN1C(=C(C(=CC2=C(N(C(=C2)C)C3=CC(=CC=C3)Br)C)C1=O)C(=O)OC)C
CCN1C(=O)C(=Cc2cc(n(c2C)c2cccc(c2)Br)C)C(=C1C)C(=O)OC
InChI=1SC22H23BrN2O3c162415(4)20(22(27)285)19(21(24)26)11161013(2)25(14(16)3)1897817(23)1218h712H6H215H3b1911
METHYL(4Z)4((1(3BROMOPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1ETHYL2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(3BROMOPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1ETHYL2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD03710885
ZINC000001160646
ZINC01160646
ZINC1160646
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