N-cyclohexyl-4-ethylsulfonyl-1-(4-fluoranyl-2-methyl-phenyl)-2-methyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-cyclohexyl-4-ethylsulfonyl-1-(4-fluoranyl-2-methyl-phenyl)-2-methyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-cyclohexyl-4-ethylsulfonyl-1-(4-fluoro-2-methyl-phenyl)-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: N-cyclohexyl-4-ethylsulfonyl-1-(4-fluoro-2-methylphenyl)-2-methyl-6-oxo-2-piperazinecarboxamide IUPAC Name: N-cyclohexyl-4-ethylsulfonyl-1-(4-fluoro-2-methylphenyl)-2-methyl-6-oxopiperazine-2-carboxamide Traditional Name: N-cyclohexyl-4-esyl-1-(4-fluoro-2-methyl-phenyl)-6-keto-2-methyl-piperazine-2-carboxamide Formula: C21H30FN3O4S MolecularWeight: 439.544003

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCCC2)C3=C(C=C(C=C3)F)C

Isomeric SMILES

CCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCCC2)C3=C(C=C(C=C3)F)C

InChI

InChI=1S/C21H30FN3O4S/c1-4-30(28,29)24-13-19(26)25(18-11-10-16(22)12-15(18)2)21(3,14-24)20(27)23-17-8-6-5-7-9-17/h10-12,17H,4-9,13-14H2,1-3H3,(H,23,27)