4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C26H20ClN3OS MolecularWeight: 457.9745

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H20ClN3OS/c1-31-23-15-9-19(10-16-23)25-28-29-26(30(25)22-13-11-21(27)12-14-22)32-17-20-7-4-6-18-5-2-3-8-24(18)20/h2-16H,17H2,1H3