Vitas-M small molecule compound
methyl 5-bromo-3-{[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)acetyl]amino}-1H-indole-2-carboxylate
Catalog ID
STK535358
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1C(C)CCc3c1ccc(c3)F)cc(cc2)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 C22H21BrFN3O3 MW 474.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrFN3O3/c1-12-3-4-13-9-15(24)6-8-18(13)27(12)11-19(28)26-20-16-10-14(23)5-7-17(16)25-21(20)22(29)30-2/h5-10,12,25H,3-4,11H2,1-2H3,(H,26,28)InChIKey
VVNVRRLKIYXNPA-UHFFFAOYSA-NSynonyms
CC1CCC2=C(N1CC(=O)NC3=C(NC4=C3C=C(C=C4)Br)C(=O)OC)C=CC(=C2)F
COC(=O)c1(nH)c2c(c1NC(=O)CN1C(C)CCc3c1ccc(c3)F)cc(cc2)Br
InChI=1SC22H21BrFN3O3c1123413915(24)6818(13)27(12)1119(28)2620161014(23)5717(16)2521(20)22(29)302h5101225H3411H212H3(H2628)
methyl5bromo3(((6fluoro2methyl34dihydroquinolin1(2H)yl)acetyl)amino)1Hindole2carboxylate
METHYL5BROMO3((2(6FLUORO2METHYL34DIHYDRO2HQUINOLIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl5bromo3(2(6fluoro2methyl34dihydroquinolin1(2H)yl)acetamido)1Hindole2carboxylate
MFCD02996346
ZINC000002304963
ZINC000002304964
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