4-[5-[(4-methylphenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[(4-methylphenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-phenethyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(4-methylphenyl)methylthio]-4-phenethyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(4-methylphenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(4-methylbenzyl)thio]-4-phenethyl-1,2,4-triazol-3-yl]pyridine Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CCC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CCC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C23H22N4S/c1-18-7-9-20(10-8-18)17-28-23-26-25-22(21-11-14-24-15-12-21)27(23)16-13-19-5-3-2-4-6-19/h2-12,14-15H,13,16-17H2,1H3