Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-(4-ethoxy-3,5-diiodophenyl)prop-2-enenitrile
Catalog ID
STK362079
SMILES CCOc1c(I)cc(cc1I)/C=C(/c1nc2c(s1)cccc2)\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 C18H12I2N2OS MW 558.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12I2N2OS/c1-2-23-17-13(19)8-11(9-14(17)20)7-12(10-21)18-22-15-5-3-4-6-16(15)24-18/h3-9H,2H2,1H3/b12-7+InChIKey
MEZZUEIRODYSGZ-KPKJPENVSA-NSynonyms
634594-96-0(2E)2(13BENZOTHIAZOL2YL)3(4ETHOXY35DIIODOPHENYL)PROP2ENENITRILE
(E)2(13BENZOTHIAZOL2YL)3(4ETHOXY35DIIODOPHENYL)PROP2ENENITRILE
634594960
CCOC1=C(C=C(C=C1I)C=C(C#N)C2=NC3=CC=CC=C3S2)I
CCOc1c(I)cc(cc1I)C=C(c1nc2c(s1)cccc2)C#N
InChI=1SC18H12I2N2OSc12231713(19)811(914(17)20)712(1021)182215534616(15)2418h39H2H21H3b127+
MFCD02915016
ZINC000101853697
ZINC101853697
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