Vitas-M small molecule compound

N'-[(3Z)-5-bromo-1-{[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl]methyl}-2-oxo-1,2-dihydro-3H-indol-3-ylidene]pyridine-3-carbohydrazide

Catalog ID
STL526889
SMILES COc1cc2c(cc1OC)CCN([C@H]2C)CN1c2ccc(cc2/C(=N/NC(=O)c2cccnc2)/C1=O)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 C27H26BrN5O4 MW 564.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26BrN5O4/c1-16-20-13-24(37-3)23(36-2)11-17(20)8-10-32(16)15-33-22-7-6-19(28)12-21(22)25(27(33)35)30-31-26(34)18-5-4-9-29-14-18/h4-7,9,11-14,16H,8,10,15H2,1-3H3,(H,31,34)/b30-25-/t16-/m0/s1
InChIKey
FITCDTKPCLSMAS-XMGGEYCVSA-N
Synonyms

(SZ)N(5bromo1((67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)methyl)2oxoindolin3ylidene)nicotinohydrazide
COc1cc2c(cc1OC)CCN((C@H)2C)CN1c2ccc(cc2C(=NNC(=O)c2cccnc2)C1=O)Br
InChI=1SC27H26BrN5O4c116201324(373)23(362)1117(20)81032(16)1533227619(28)1221(22)25(27(33)35)303126(34)18549291418h479111416H81015H213H3(H3134)b3025t16m0s1
MFCD01845636
N((3Z)5bromo1(((1S)67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)methyl)2oxo12dihydro3Hindol3ylidene)pyridine3carbohydrazide
ZINC000070672224

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Available files

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