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

Systemtic Name: 4-[5-[(4-chlorophenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(4-chlorophenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(4-chlorophenyl)methylthio]-4-phenethyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(4-chlorophenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(4-chlorobenzyl)thio]-4-phenethyl-1,2,4-triazol-3-yl]pyridine Formula: C22H19ClN4S MolecularWeight: 406.93106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NN=C2SCC3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NN=C2SCC3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C22H19ClN4S/c23-20-8-6-18(7-9-20)16-28-22-26-25-21(19-10-13-24-14-11-19)27(22)15-12-17-4-2-1-3-5-17/h1-11,13-14H,12,15-16H2