3-ethoxy-4-[2-[[4-ethyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde

Systemtic Name: 3-ethoxy-4-[2-[[4-ethyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde Openeye Name: 3-ethoxy-4-[2-[[4-ethyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde CAS Name: 3-ethoxy-4-[2-[[4-ethyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzaldehyde IUPAC Name: 3-ethoxy-4-[2-[[4-ethyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde Traditional Name: 3-ethoxy-4-[2-[[4-ethyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzaldehyde Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCOC2=C(C=C(C=C2)C=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCCOC2=C(C=C(C=C2)C=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H25N3O3S/c1-4-25-21(18-9-6-16(3)7-10-18)23-24-22(25)29-13-12-28-19-11-8-17(15-26)14-20(19)27-5-2/h6-11,14-15H,4-5,12-13H2,1-3H3