Vitas-M small molecule compound
methyl (4Z)-4-(4-bromobenzylidene)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161469
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)Br)CCC1=CCCCC1
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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 C22H24BrNO3 MW 430.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrNO3/c1-15-20(22(26)27-2)19(14-17-8-10-18(23)11-9-17)21(25)24(15)13-12-16-6-4-3-5-7-16/h6,8-11,14H,3-5,7,12-13H2,1-2H3/b19-14-InChIKey
LFEXRGIQCHTETF-RGEXLXHISA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)Br)C(=O)N1CCC3=CCCCC3)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)Br)CCC1=CCCCC1
InChI=1SC22H24BrNO3c11520(22(26)272)19(141781018(23)11917)21(25)24(15)1312166435716h681114H3571213H212H3b1914
METHYL(4Z)4((4BROMOPHENYL)METHYLIDENE)1(2(CYCLOHEXEN1YL)ETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)4(4BROMOBENZYLIDENE)1(2(CYCLOHEX1EN1YL)ETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03252182
ZINC000008872616
ZINC08872616
ZINC8872616
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