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

Systemtic Name: 3-(3-chlorophenyl)-4-(2-methoxyphenyl)-5-(3-phenylpropylsulfanyl)-1,2,4-triazole Openeye Name: 3-(3-chlorophenyl)-4-(2-methoxyphenyl)-5-(3-phenylpropylsulfanyl)-1,2,4-triazole CAS Name: 3-(3-chlorophenyl)-4-(2-methoxyphenyl)-5-(3-phenylpropylthio)-1,2,4-triazole IUPAC Name: 3-(3-chlorophenyl)-4-(2-methoxyphenyl)-5-(3-phenylpropylsulfanyl)-1,2,4-triazole Traditional Name: 3-(3-chlorophenyl)-4-(2-methoxyphenyl)-5-(3-phenylpropylthio)-1,2,4-triazole Formula: C24H22ClN3OS MolecularWeight: 435.96898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=C2SCCCC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=C2SCCCC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H22ClN3OS/c1-29-22-15-6-5-14-21(22)28-23(19-12-7-13-20(25)17-19)26-27-24(28)30-16-8-11-18-9-3-2-4-10-18/h2-7,9-10,12-15,17H,8,11,16H2,1H3