3-[[5-(diphenylmethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]thiolane 1,1-dioxide

Systemtic Name: 3-[[5-(diphenylmethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]thiolane 1,1-dioxide Openeye Name: 3-[(5-benzhydrylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]thiolane 1,1-dioxide CAS Name: 3-[[5-[(diphenylmethyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]thiolane 1,1-dioxide IUPAC Name: 3-[(5-benzhydrylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]thiolane 1,1-dioxide Traditional Name: 3-[[5-(benzhydrylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]sulfolane Formula: C21H23N3O2S2 MolecularWeight: 413.55622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC(C2=CC=CC=C2)C3=CC=CC=C3)CC4CCS(=O)(=O)C4

Isomeric SMILES

CN1C(=NN=C1SC(C2=CC=CC=C2)C3=CC=CC=C3)CC4CCS(=O)(=O)C4

InChI

InChI=1S/C21H23N3O2S2/c1-24-19(14-16-12-13-28(25,26)15-16)22-23-21(24)27-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,20H,12-15H2,1H3