N-(3-chloranyl-4-fluoranyl-phenyl)-4-[(2-chlorophenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-[(2-chlorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-[(2-chlorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-[(2-chlorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-[(2-chlorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(2-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=C2Cl)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

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