3-(4-chlorophenyl)-4-(3-methylphenyl)-5-phenethylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-4-(3-methylphenyl)-5-phenethylsulfanyl-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-4-(m-tolyl)-5-phenethylsulfanyl-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-4-(3-methylphenyl)-5-(phenethylthio)-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-4-(3-methylphenyl)-5-phenethylsulfanyl-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-4-(m-tolyl)-5-(phenethylthio)-1,2,4-triazole Formula: C23H20ClN3S MolecularWeight: 405.943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCCC3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCCC3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H20ClN3S/c1-17-6-5-9-21(16-17)27-22(19-10-12-20(24)13-11-19)25-26-23(27)28-15-14-18-7-3-2-4-8-18/h2-13,16H,14-15H2,1H3