3-(4-chlorophenyl)-5-(2-phenoxyethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-5-(2-phenoxyethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-(4-chlorophenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-5-(2-phenoxyethylthio)-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-(4-chlorophenyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 4-benzyl-3-(4-chlorophenyl)-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C23H20ClN3OS MolecularWeight: 421.9424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H20ClN3OS/c24-20-13-11-19(12-14-20)22-25-26-23(27(22)17-18-7-3-1-4-8-18)29-16-15-28-21-9-5-2-6-10-21/h1-14H,15-17H2