Vitas-M small molecule compound
(5Z)-2-amino-5-{[1-(2-cyanobenzyl)-1H-indol-3-yl]methylidene}-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Catalog ID
STK131569
SMILES N#CC1=C(C)/C(=C/c2cn(c3c2cccc3)Cc2ccccc2C#N)/c2c1nc(N)c(c2C)C#N
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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 C29H20N6 MW 452.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20N6/c1-17-23(27-18(2)25(14-32)29(33)34-28(27)24(17)13-31)11-21-16-35(26-10-6-5-9-22(21)26)15-20-8-4-3-7-19(20)12-30/h3-11,16H,15H2,1-2H3,(H2,33,34)/b23-11-InChIKey
WPMCMJMNBHMRHI-KSEXSDGBSA-NSynonyms
(5Z)2amino5((1((2cyanophenyl)methyl)indol3yl)methylidene)46dimethylcyclopenta(b)pyridine37dicarbonitrile
(5Z)2AMINO5((1(2CYANOBENZYL)1HINDOL3YL)METHYLIDENE)46DIMETHYL5HCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
CC1=C(C2=C(C1=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5C#N)C(=C(C(=N2)N)C#N)C)C#N
InChI=1SC29H20N6c11723(2718(2)25(1432)29(33)3428(27)24(17)1331)11211635(261065922(21)26)1520843719(20)1230h31116H15H212H3(H23334)b2311
MFCD06253145
N#CC1=C(C)C(=Cc2cn(c3c2cccc3)Cc2ccccc2C#N)c2c1nc(N)c(c2C)C#N
ZINC000100392624
ZINC100392624
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