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

Systemtic Name: 3-[5-(oxan-2-ylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[4-phenyl-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-(2-oxanylmethylthio)-4-phenyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-(oxan-2-ylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[4-phenyl-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazol-3-yl]pyridine Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C19H20N4OS/c1-2-8-16(9-3-1)23-18(15-7-6-11-20-13-15)21-22-19(23)25-14-17-10-4-5-12-24-17/h1-3,6-9,11,13,17H,4-5,10,12,14H2