N-(3-chloranyl-4-fluoranyl-phenyl)-4-(2-methylpropyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(2-methylpropyl)piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-isobutyl-piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-(2-methylpropyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-(2-methylpropyl)piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-isobutyl-piperazine-1-carbothioamide Formula: C15H21ClFN3S MolecularWeight: 329.863743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(C)CN1CCN(CC1)C(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H21ClFN3S/c1-11(2)10-19-5-7-20(8-6-19)15(21)18-12-3-4-14(17)13(16)9-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,18,21)