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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-[(2,4-dichlorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-(2,4-dichlorobenzyl)piperazine-1-carbothioamide Formula: C18H17Cl3FN3S MolecularWeight: 432.770083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17Cl3FN3S/c19-13-2-1-12(15(20)9-13)11-24-5-7-25(8-6-24)18(26)23-14-3-4-17(22)16(21)10-14/h1-4,9-10H,5-8,11H2,(H,23,26)