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

Systemtic Name: 4-[5-(oxan-2-ylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[4-phenyl-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[5-(2-oxanylmethylthio)-4-phenyl-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[5-(oxan-2-ylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[4-phenyl-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazol-3-yl]morpholine Formula: C18H24N4O2S MolecularWeight: 360.47376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(N2C3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(N2C3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C18H24N4O2S/c1-2-6-15(7-3-1)22-17(21-9-12-23-13-10-21)19-20-18(22)25-14-16-8-4-5-11-24-16/h1-3,6-7,16H,4-5,8-14H2