Vitas-M small molecule compound
ethyl {3-[(Z)-(2-amino-3,7-dicyano-4,6-dimethyl-5H-cyclopenta[b]pyridin-5-ylidene)methyl]-1H-indol-1-yl}acetate
Catalog ID
STK042987
SMILES CCOC(=O)Cn1cc(c2c1cccc2)/C=C\1/C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)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 C25H21N5O2 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O2/c1-4-32-22(31)13-30-12-16(17-7-5-6-8-21(17)30)9-18-14(2)19(10-26)24-23(18)15(3)20(11-27)25(28)29-24/h5-9,12H,4,13H2,1-3H3,(H2,28,29)/b18-9-InChIKey
ULJXLJFIHZJCKT-NVMNQCDNSA-NSynonyms
(E)ethyl2(3((2amino37dicyano46dimethyl5Hcyclopenta(b)pyridin5ylidene)methyl)1Hindol1yl)acetate
CCOC(=O)CN1C=C(C2=CC=CC=C21)C=C3C(=C(C4=C3C(=C(C(=N4)N)C#N)C)C#N)C
CCOC(=O)Cn1cc(c2c1cccc2)C=C1C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C
ETHYL(3((Z)(2AMINO37DICYANO46DIMETHYL5HCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)1HINDOL1YL)ACETATE
ETHYL2(3((Z)(2AMINO37DICYANO46DIMETHYLCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)INDOL1YL)ACETATE
InChI=1SC25H21N5O2c143222(31)13301216(17756821(17)30)91814(2)19(1026)2423(18)15(3)20(1127)25(28)2924h5912H413H213H3(H22829)b189
MFCD03700030
STK042987
ZINC000101430071
ZINC101430071
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