N-cycloheptyl-1-(4-fluorophenyl)-2-methyl-6-oxidanylidene-4-propylsulfonyl-piperazine-2-carboxamide

Systemtic Name: N-cycloheptyl-1-(4-fluorophenyl)-2-methyl-6-oxidanylidene-4-propylsulfonyl-piperazine-2-carboxamide Openeye Name: N-cycloheptyl-1-(4-fluorophenyl)-2-methyl-6-oxo-4-propylsulfonyl-piperazine-2-carboxamide CAS Name: N-cycloheptyl-1-(4-fluorophenyl)-2-methyl-6-oxo-4-propylsulfonyl-2-piperazinecarboxamide IUPAC Name: N-cycloheptyl-1-(4-fluorophenyl)-2-methyl-6-oxo-4-propylsulfonylpiperazine-2-carboxamide Traditional Name: N-cycloheptyl-1-(4-fluorophenyl)-6-keto-2-methyl-4-propylsulfonyl-piperazine-2-carboxamide Formula: C22H32FN3O4S MolecularWeight: 453.570583

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H32FN3O4S/c1-3-14-31(29,30)25-15-20(27)26(19-12-10-17(23)11-13-19)22(2,16-25)21(28)24-18-8-6-4-5-7-9-18/h10-13,18H,3-9,14-16H2,1-2H3,(H,24,28)