Vitas-M small molecule compound
5-amino-3-{(Z)-1-cyano-2-[3,5-diiodo-2-(propan-2-yloxy)phenyl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Catalog ID
STK674787
SMILES OCCn1nc(c(c1N)C#N)/C(=C/c1cc(I)cc(c1OC(C)C)I)/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 C18H17I2N5O2 MW 589.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17I2N5O2/c1-10(2)27-17-11(6-13(19)7-15(17)20)5-12(8-21)16-14(9-22)18(23)25(24-16)3-4-26/h5-7,10,26H,3-4,23H2,1-2H3/b12-5+InChIKey
RDJYAJDOSASXAG-LFYBBSHMSA-NSynonyms
5amino3((Z)1cyano2(35diiodo2(propan2yloxy)phenyl)ethenyl)1(2hydroxyethyl)1Hpyrazole4carbonitrile
5AMINO3((Z)1CYANO2(35DIIODO2PROPAN2YLOXYPHENYL)ETHENYL)1(2HYDROXYETHYL)PYRAZOLE4CARBONITRILE
5AMINO3(1CYANO2(35DIIODO2ISOPROPOXYPHENYL)VINYL)1(2HYDROXYETHYL)1HPYRAZOLE4CARBONITRILE
CC(C)OC1=C(C=C(C=C1C=C(C#N)C2=NN(C(=C2C#N)N)CCO)I)I
InChI=1SC18H17I2N5O2c110(2)271711(613(19)715(17)20)512(821)1614(922)18(23)25(2416)3426h571026H3423H212H3b125+
MFCD01359741
OCCn1nc(c(c1N)C#N)C(=Cc1cc(I)cc(c1OC(C)C)I)C#N
ZINC000008424404
ZINC08424404
ZINC8424404
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