4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N-cyclopentyl-piperazine-1-carbothioamide

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N-cyclopentyl-piperazine-1-carbothioamide Openeye Name: 4-[(3-chloro-4-fluoro-phenyl)methyl]-N-cyclopentyl-piperazine-1-carbothioamide CAS Name: 4-[(3-chloro-4-fluorophenyl)methyl]-N-cyclopentyl-1-piperazinecarbothioamide IUPAC Name: 4-[(3-chloro-4-fluorophenyl)methyl]-N-cyclopentylpiperazine-1-carbothioamide Traditional Name: 4-(3-chloro-4-fluoro-benzyl)-N-cyclopentyl-piperazine-1-carbothioamide Formula: C17H23ClFN3S MolecularWeight: 355.901023

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)N2CCN(CC2)CC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(C1)NC(=S)N2CCN(CC2)CC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H23ClFN3S/c18-15-11-13(5-6-16(15)19)12-21-7-9-22(10-8-21)17(23)20-14-3-1-2-4-14/h5-6,11,14H,1-4,7-10,12H2,(H,20,23)