4-[3-[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-(4-isobutyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[4-(2-methylpropyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-isobutyl-5-(phenethylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C24H30N4O3S2 MolecularWeight: 486.65

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCCC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC(C)CN1C(=NN=C1SCCC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H30N4O3S2/c1-19(2)18-28-23(25-26-24(28)32-16-11-20-7-4-3-5-8-20)21-9-6-10-22(17-21)33(29,30)27-12-14-31-15-13-27/h3-10,17,19H,11-16,18H2,1-2H3