N-(3,4-dichlorophenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dichlorophenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3,4-dichlorophenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(3,4-dichlorophenyl)-4-[(4-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dichlorophenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3,4-dichlorophenyl)-4-(4-fluorobenzyl)piperazine-1-carbothioamide Formula: C18H18Cl2FN3S MolecularWeight: 398.325023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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