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

Systemtic Name: 3-ethoxy-4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde Openeye Name: 3-ethoxy-4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde CAS Name: 3-ethoxy-4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethoxy]benzaldehyde IUPAC Name: 3-ethoxy-4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde Traditional Name: 3-ethoxy-4-[2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethoxy]benzaldehyde Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OCCSC2=NN=C(N2C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OCCSC2=NN=C(N2C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N3O4S/c1-4-27-19-13-15(14-25)5-10-18(19)28-11-12-29-21-23-22-20(24(21)2)16-6-8-17(26-3)9-7-16/h5-10,13-14H,4,11-12H2,1-3H3