1-(3-chloranyl-2-methyl-phenyl)-N-cyclopentyl-2-methyl-6-oxidanylidene-4-propylsulfonyl-piperazine-2-carboxamide

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-N-cyclopentyl-2-methyl-6-oxidanylidene-4-propylsulfonyl-piperazine-2-carboxamide Openeye Name: 1-(3-chloro-2-methyl-phenyl)-N-cyclopentyl-2-methyl-6-oxo-4-propylsulfonyl-piperazine-2-carboxamide CAS Name: 1-(3-chloro-2-methylphenyl)-N-cyclopentyl-2-methyl-6-oxo-4-propylsulfonyl-2-piperazinecarboxamide IUPAC Name: 1-(3-chloro-2-methylphenyl)-N-cyclopentyl-2-methyl-6-oxo-4-propylsulfonylpiperazine-2-carboxamide Traditional Name: 1-(3-chloro-2-methyl-phenyl)-N-cyclopentyl-6-keto-2-methyl-4-propylsulfonyl-piperazine-2-carboxamide Formula: C21H30ClN3O4S MolecularWeight: 455.9986

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCC2)C3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CCCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCC2)C3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C21H30ClN3O4S/c1-4-12-30(28,29)24-13-19(26)25(18-11-7-10-17(22)15(18)2)21(3,14-24)20(27)23-16-8-5-6-9-16/h7,10-11,16H,4-6,8-9,12-14H2,1-3H3,(H,23,27)