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

Systemtic Name: 4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(3,4-dichlorophenyl)methylthio]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(3,4-dichlorobenzyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]pyridine Formula: C21H16Cl2N4S MolecularWeight: 427.34954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=C(C=C3)Cl)Cl)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=C(C=C3)Cl)Cl)C4=CC=NC=C4

InChI

InChI=1S/C21H16Cl2N4S/c1-14-2-5-17(6-3-14)27-20(16-8-10-24-11-9-16)25-26-21(27)28-13-15-4-7-18(22)19(23)12-15/h2-12H,13H2,1H3