2-[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 2-[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 2-[5-[(2,5-dimethylphenyl)methylthio]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 2-[5-[(2,5-dimethylbenzyl)thio]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]pyridine Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=CC=N4

InChI

InChI=1S/C23H22N4OS/c1-16-7-8-17(2)18(14-16)15-29-23-26-25-22(21-6-4-5-13-24-21)27(23)19-9-11-20(28-3)12-10-19/h4-14H,15H2,1-3H3