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

Systemtic Name: 4-[3-(4-cycloheptyl-5-methylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Openeye Name: 4-[3-(4-cycloheptyl-5-methylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine CAS Name: 4-[3-[4-cycloheptyl-5-(methylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-(4-cycloheptyl-5-methylsulfanyl-1,2,4-triazol-3-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[3-[4-cycloheptyl-5-(methylthio)-1,2,4-triazol-3-yl]phenyl]sulfonylmorpholine Formula: C20H28N4O3S2 MolecularWeight: 436.59132

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCCCC2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CSC1=NN=C(N1C2CCCCCC2)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H28N4O3S2/c1-28-20-22-21-19(24(20)17-8-4-2-3-5-9-17)16-7-6-10-18(15-16)29(25,26)23-11-13-27-14-12-23/h6-7,10,15,17H,2-5,8-9,11-14H2,1H3