N-(3-chloranyl-4-fluoranyl-phenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C17H15ClFN3O4S MolecularWeight: 411.835103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H15ClFN3O4S/c18-14-9-12(4-5-15(14)19)21-17(24)11-2-1-3-13(8-11)27(25,26)22-7-6-20-16(23)10-22/h1-5,8-9H,6-7,10H2,(H,20,23)(H,21,24)