4-[3-(4-cycloheptyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-(4-cycloheptyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Openeye Name: 4-[3-(4-cycloheptyl-5-isopropylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[4-cycloheptyl-5-(propan-2-ylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-(4-cycloheptyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-cycloheptyl-5-(isopropylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C22H32N4O3S2 MolecularWeight: 464.64448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1C2CCCCCC2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC(C)SC1=NN=C(N1C2CCCCCC2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H32N4O3S2/c1-17(2)30-22-24-23-21(26(22)19-9-5-3-4-6-10-19)18-8-7-11-20(16-18)31(27,28)25-12-14-29-15-13-25/h7-8,11,16-17,19H,3-6,9-10,12-15H2,1-2H3