Vitas-M small molecule compound
{3-acetyl-2-(4-bromophenyl)-4-[(4-methoxyphenyl)amino]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}acetic acid
Catalog ID
STK680951
SMILES COc1ccc(cc1)NC1=C(C(=O)C)C(N(C1=O)CC(=O)O)c1ccc(cc1)Br
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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 C21H19BrN2O5 MW 459.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O5/c1-12(25)18-19(23-15-7-9-16(29-2)10-8-15)21(28)24(11-17(26)27)20(18)13-3-5-14(22)6-4-13/h3-10,20,23H,11H2,1-2H3,(H,26,27)InChIKey
GCRUBXVOLGZDNF-UHFFFAOYSA-NSynonyms
(3acetyl2(4bromophenyl)4((4methoxyphenyl)amino)5oxo25dihydro1Hpyrrol1yl)aceticacid
2(3ACETYL2(4BROMOPHENYL)4((4METHOXYPHENYL)AMINO)5OXO3PYRROLINYL)ACETICACID
2(3ACETYL2(4BROMOPHENYL)4(4METHOXYANILINO)5OXO2HPYRROL1YL)ACETICACID
CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)Br)CC(=O)O)NC3=CC=C(C=C3)OC
InChI=1SC21H19BrN2O5c112(25)1819(23157916(292)10815)21(28)24(1117(26)27)20(18)133514(22)6413h3102023H11H212H3(H2627)
MFCD03767787
ZINC000003624401
ZINC000003624403
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