Vitas-M small molecule compound
{4-[(Z)-(2-amino-3,7-dicyano-4,6-dimethyl-5H-cyclopenta[b]pyridin-5-ylidene)methyl]-2,6-dichlorophenoxy}acetic acid
Catalog ID
STK169468
SMILES N#CC1=C(C)/C(=C/c2cc(Cl)c(c(c2)Cl)OCC(=O)O)/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 C21H14Cl2N4O3 MW 441.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14Cl2N4O3/c1-9-12(3-11-4-15(22)20(16(23)5-11)30-8-17(28)29)18-10(2)14(7-25)21(26)27-19(18)13(9)6-24/h3-5H,8H2,1-2H3,(H2,26,27)(H,28,29)/b12-3-InChIKey
ZWCHZAWDRBJGOO-BASWHVEKSA-NSynonyms
(4((2AMINO37DICYANO46DIMETHYL5HCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)26DICHLOROPHENOXY)ACETICACID
(4((Z)(2AMINO37DICYANO46DIMETHYL5HCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)26DICHLOROPHENOXY)ACETICACID
(E)2(4((2amino37dicyano46dimethyl5Hcyclopenta(b)pyridin5ylidene)methyl)26dichlorophenoxy)aceticacid
2(4((Z)(2AMINO37DICYANO46DIMETHYLCYCLOPENTA(B)PYRIDIN1IUM5YLIDENE)METHYL)26DICHLOROPHENOXY)ACETATE
2(4((Z)(2AMINO37DICYANO46DIMETHYLCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)26DICHLOROPHENOXY)ACETICACID
CC1=C(C2=C(C1=CC3=CC(=C(C(=C3)Cl)OCC(=O)(O))Cl)C(=C(C(=(NH+)2)N)C#N)C)C#N
InChI=1SC21H14Cl2N4O3c1912(311415(22)20(16(23)511)30817(28)29)1810(2)14(725)21(26)2719(18)13(9)624h35H8H212H3(H22627)(H2829)b123
MFCD03700020
N#CC1=C(C)C(=Cc2cc(Cl)c(c(c2)Cl)OCC(=O)O)c2c1nc(N)c(c2C)C#N
ZINC000101675801
ZINC101675801
Check stock
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