4-[3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C22H24N4O3S2 MolecularWeight: 456.58096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C22H24N4O3S2/c27-31(28,25-11-13-29-14-12-25)20-8-4-5-17(15-20)16-30-22-24-23-21(18-9-10-18)26(22)19-6-2-1-3-7-19/h1-8,15,18H,9-14,16H2