Vitas-M small molecule compound
N'-{(3Z)-5-bromo-2-oxo-1-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]-1,2-dihydro-3H-indol-3-ylidene}-4-methoxybenzohydrazide
Catalog ID
STK049146
SMILES COc1ccc(cc1)C(=O)N/N=C\1/c2cc(Br)ccc2N(C1=O)CN1CC2(CC1CC(C2)(C)C)C
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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 C27H31BrN4O3 MW 539.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31BrN4O3/c1-26(2)12-19-13-27(3,14-26)15-31(19)16-32-22-10-7-18(28)11-21(22)23(25(32)34)29-30-24(33)17-5-8-20(35-4)9-6-17/h5-11,19H,12-16H2,1-4H3,(H,30,33)/b29-23-InChIKey
PTONSBDDOZJTES-FAJYDZGRSA-NSynonyms
627054-72-2627054722
CC1(CC2CC(C1)(CN2CN3C4=C(C=C(C=C4)Br)C(=NNC(=O)C5=CC=C(C=C5)OC)C3=O)C)C
COc1ccc(cc1)C(=O)NN=C1c2cc(Br)ccc2N(C1=O)CN1CC2(CC1CC(C2)(C)C)C
InChI=1SC27H31BrN4O3c126(2)12191327(31426)1531(19)16322210718(28)1121(22)23(25(32)34)293024(33)175820(354)9617h51119H1216H214H3(H3033)b2923
MFCD04109135
N((3Z)5BROMO2OXO1((133TRIMETHYL6AZABICYCLO(321)OCT6YL)METHYL)12DIHYDRO3HINDOL3YLIDENE)4METHOXYBENZOHYDRAZIDE
N((Z)(5bromo2oxo1((335trimethyl7azabicyclo(321)octan7yl)methyl)indol3ylidene)amino)4methoxybenzamide
STK049146
ZINC000101439733
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