N-cycloheptyl-1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-cycloheptyl-1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-cycloheptyl-1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: N-cycloheptyl-1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxo-2-piperazinecarboxamide IUPAC Name: N-cycloheptyl-1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxopiperazine-2-carboxamide Traditional Name: N-cycloheptyl-1-(3,4-dimethylphenyl)-4-esyl-6-keto-2-methyl-piperazine-2-carboxamide Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCCCC2)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCCCC2)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C23H35N3O4S/c1-5-31(29,30)25-15-21(27)26(20-13-12-17(2)18(3)14-20)23(4,16-25)22(28)24-19-10-8-6-7-9-11-19/h12-14,19H,5-11,15-16H2,1-4H3,(H,24,28)