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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-[(3-chlorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-[(3-chlorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-[(3-chlorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-[(3-chlorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(3-chlorobenzyl)-N-(3-chloro-4-fluoro-phenyl)piperazine-1-carbothioamide Formula: C18H18Cl2FN3S MolecularWeight: 398.325023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H18Cl2FN3S/c19-14-3-1-2-13(10-14)12-23-6-8-24(9-7-23)18(25)22-15-4-5-17(21)16(20)11-15/h1-5,10-11H,6-9,12H2,(H,22,25)