3-[4-phenyl-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[4-phenyl-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[4-phenyl-5-(4-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-phenyl-5-(pyridin-4-ylmethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-phenyl-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[4-phenyl-5-(4-pyridylmethylthio)-1,2,4-triazol-3-yl]pyridine Formula: C19H15N5S MolecularWeight: 345.4209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15N5S/c1-2-6-17(7-3-1)24-18(16-5-4-10-21-13-16)22-23-19(24)25-14-15-8-11-20-12-9-15/h1-13H,14H2