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

Systemtic Name: 1-(3-chlorophenyl)-N-cycloheptyl-4-ethylsulfonyl-2-methyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: 1-(3-chlorophenyl)-N-cycloheptyl-4-ethylsulfonyl-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: 1-(3-chlorophenyl)-N-cycloheptyl-4-ethylsulfonyl-2-methyl-6-oxo-2-piperazinecarboxamide IUPAC Name: 1-(3-chlorophenyl)-N-cycloheptyl-4-ethylsulfonyl-2-methyl-6-oxopiperazine-2-carboxamide Traditional Name: 1-(3-chlorophenyl)-N-cycloheptyl-4-esyl-6-keto-2-methyl-piperazine-2-carboxamide Formula: C21H30ClN3O4S MolecularWeight: 455.9986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30ClN3O4S/c1-3-30(28,29)24-14-19(26)25(18-12-8-9-16(22)13-18)21(2,15-24)20(27)23-17-10-6-4-5-7-11-17/h8-9,12-13,17H,3-7,10-11,14-15H2,1-2H3,(H,23,27)