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

Systemtic Name: 4-[2-[[4-ethyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]-3-methoxy-benzaldehyde Openeye Name: 4-[2-[[4-ethyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]-3-methoxy-benzaldehyde CAS Name: 4-[2-[[4-ethyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]ethoxy]-3-methoxybenzaldehyde IUPAC Name: 4-[2-[[4-ethyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]-3-methoxybenzaldehyde Traditional Name: 4-[2-[[4-ethyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]ethoxy]-3-methoxy-benzaldehyde Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-4-24-20(17-8-5-15(2)6-9-17)22-23-21(24)28-12-11-27-18-10-7-16(14-25)13-19(18)26-3/h5-10,13-14H,4,11-12H2,1-3H3