Vitas-M small molecule compound
2-{[(E)-(4-ethoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK750778
SMILES CCOc1ccc(cc1)/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 C18H18N2OS MW 310.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2OS/c1-2-21-14-9-7-13(8-10-14)12-20-18-16(11-19)15-5-3-4-6-17(15)22-18/h7-10,12H,2-6H2,1H3/b20-12+InChIKey
PLGFXIQONXAQAH-UDWIEESQSA-NSynonyms
2(((E)(4ethoxyphenyl)methylidene)amino)4567tetrahydro1benzothiophene3carbonitrile
2((E)(4ethoxyphenyl)methylideneamino)4567tetrahydro1benzothiophene3carbonitrile
CCOC1=CC=C(C=C1)C=NC2=C(C3=C(S2)CCCC3)C#N
CCOc1ccc(cc1)C=Nc1sc2c(c1C#N)CCCC2
InChI=1SC18H18N2OSc1221149713(81014)12201816(1119)15534617(15)2218h71012H26H21H3b2012+
MFCD00739303
ZINC000000050437
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