Vitas-M small molecule compound
2-{[(E)-(3,5-diiodo-4-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK204982
SMILES COc1c(I)cc(cc1I)/C=N/c1sc2c(c1C#N)CCCC2
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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 C17H14I2N2OS MW 548.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14I2N2OS/c1-22-16-13(18)6-10(7-14(16)19)9-21-17-12(8-20)11-4-2-3-5-15(11)23-17/h6-7,9H,2-5H2,1H3/b21-9+InChIKey
GNADMKARWVHKMT-ZVBGSRNCSA-NSynonyms
2(((E)(35diiodo4methoxyphenyl)methylidene)amino)4567tetrahydro1benzothiophene3carbonitrile
2((E)(35diiodo4methoxyphenyl)methylideneamino)4567tetrahydro1benzothiophene3carbonitrile
COC1=C(C=C(C=C1I)C=NC2=C(C3=C(S2)CCCC3)C#N)I
COc1c(I)cc(cc1I)C=Nc1sc2c(c1C#N)CCCC2
InChI=1SC17H14I2N2OSc1221613(18)610(714(16)19)9211712(820)11423515(11)2317h679H25H21H3b219+
MFCD01061960
ZINC000100058656
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