2-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]pyridine

Systemtic Name: 2-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]pyridine Openeye Name: 2-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)pyridine CAS Name: 2-[3-(phenylmethylthio)-1H-1,2,4-triazol-5-yl]pyridine IUPAC Name: 2-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)pyridine Traditional Name: 2-[3-(benzylthio)-1H-1,2,4-triazol-5-yl]pyridine Formula: C14H12N4S MolecularWeight: 268.33688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=CC=N3

InChI

InChI=1S/C14H12N4S/c1-2-6-11(7-3-1)10-19-14-16-13(17-18-14)12-8-4-5-9-15-12/h1-9H,10H2,(H,16,17,18)