4-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-(3-chloro-4-fluoro-phenyl)sulfonyl-piperazine-1-carboxamide CAS Name: 4-(3-chloro-4-fluorophenyl)sulfonyl-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-(3-chloro-4-fluorophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-benzyl-4-(3-chloro-4-fluoro-phenyl)sulfonyl-piperazine-1-carboxamide Formula: C18H19ClFN3O3S MolecularWeight: 411.878163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H19ClFN3O3S/c19-16-12-15(6-7-17(16)20)27(25,26)23-10-8-22(9-11-23)18(24)21-13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,21,24)