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

Systemtic Name: 4-[4-methyl-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(4-isopropylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-methyl-5-[(4-propan-2-ylphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-methyl-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(4-isopropylbenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]pyridine Formula: C18H20N4S MolecularWeight: 324.4432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC=NC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC=NC=C3

InChI

InChI=1S/C18H20N4S/c1-13(2)15-6-4-14(5-7-15)12-23-18-21-20-17(22(18)3)16-8-10-19-11-9-16/h4-11,13H,12H2,1-3H3