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

Systemtic Name: 3-[5-[(3,4-dimethylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(3,4-dimethylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[(3,4-dimethylphenyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-[(3,4-dimethylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[(3,4-dimethylbenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]pyridine Formula: C22H20N4S MolecularWeight: 372.486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4)C

InChI

InChI=1S/C22H20N4S/c1-16-10-11-18(13-17(16)2)15-27-22-25-24-21(19-7-6-12-23-14-19)26(22)20-8-4-3-5-9-20/h3-14H,15H2,1-2H3