4-butyl-N-(3-chloranyl-4-fluoranyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-butyl-N-(3-chloranyl-4-fluoranyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-butyl-N-(3-chloro-4-fluoro-phenyl)piperazine-1-carbothioamide CAS Name: 4-butyl-N-(3-chloro-4-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-butyl-N-(3-chloro-4-fluorophenyl)piperazine-1-carbothioamide Traditional Name: 4-butyl-N-(3-chloro-4-fluoro-phenyl)piperazine-1-carbothioamide Formula: C15H21ClFN3S MolecularWeight: 329.863743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCCCN1CCN(CC1)C(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H21ClFN3S/c1-2-3-6-19-7-9-20(10-8-19)15(21)18-12-4-5-14(17)13(16)11-12/h4-5,11H,2-3,6-10H2,1H3,(H,18,21)