Vitas-M small molecule compound
ethyl (4Z)-4-{[1-(3-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK019556
SMILES COCCN1C(=O)/C(=C\c2cc(n(c2C)c2cccc(c2)Br)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 C24H27BrN2O4 MW 487.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27BrN2O4/c1-6-31-24(29)22-17(4)26(10-11-30-5)23(28)21(22)13-18-12-15(2)27(16(18)3)20-9-7-8-19(25)14-20/h7-9,12-14H,6,10-11H2,1-5H3/b21-13-InChIKey
LDTSRRVLXMZWAL-BKUYFWCQSA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1=CC2=C(N(C(=C2)C)C3=CC(=CC=C3)Br)C)CCOC)C
COCCN1C(=O)C(=Cc2cc(n(c2C)c2cccc(c2)Br)C)C(=C1C)C(=O)OCC
ETHYL(4Z)4((1(3BROMOPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((1(3BROMOPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
InChI=1SC24H27BrN2O4c163124(29)2217(4)26(1011305)23(28)21(22)13181215(2)27(16(18)3)2097819(25)1420h791214H61011H215H3b2113
MFCD03269998
STK019556
ZINC000008986359
ZINC08986359
ZINC8986359
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