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

Systemtic Name: 4-[(3,4-dichlorophenyl)methyl]-N-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-[(3,4-dichlorophenyl)methyl]-N-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide CAS Name: 4-[(3,4-dichlorophenyl)methyl]-N-[(4-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(3,4-dichlorophenyl)methyl]-N-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(3,4-dichlorobenzyl)-N-(4-fluorobenzyl)piperazine-1-carbothioamide Formula: C19H20Cl2FN3S MolecularWeight: 412.351603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)C(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)C(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H20Cl2FN3S/c20-17-6-3-15(11-18(17)21)13-24-7-9-25(10-8-24)19(26)23-12-14-1-4-16(22)5-2-14/h1-6,11H,7-10,12-13H2,(H,23,26)