3-[5-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[5-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[(3,4-dichlorophenyl)methylthio]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[(3,4-dichlorobenzyl)thio]-4-p-phenetyl-1,2,4-triazol-3-yl]pyridine Formula: C22H18Cl2N4OS MolecularWeight: 457.37552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=C(C=C3)Cl)Cl)C4=CN=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=C(C=C3)Cl)Cl)C4=CN=CC=C4

InChI

InChI=1S/C22H18Cl2N4OS/c1-2-29-18-8-6-17(7-9-18)28-21(16-4-3-11-25-13-16)26-27-22(28)30-14-15-5-10-19(23)20(24)12-15/h3-13H,2,14H2,1H3