4-[4-phenyl-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[4-phenyl-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(4-isopropylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-phenyl-5-[(4-propan-2-ylphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-phenyl-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(4-isopropylbenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]pyridine Formula: C23H22N4S MolecularWeight: 386.51258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C23H22N4S/c1-17(2)19-10-8-18(9-11-19)16-28-23-26-25-22(20-12-14-24-15-13-20)27(23)21-6-4-3-5-7-21/h3-15,17H,16H2,1-2H3