N-[(2,4-dichlorophenyl)methyl]-4-(4-fluorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-4-(4-fluorophenyl)piperazine-1-carbothioamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-4-(4-fluorophenyl)piperazine-1-carbothioamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-4-(4-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-4-(4-fluorophenyl)piperazine-1-carbothioamide Traditional Name: N-(2,4-dichlorobenzyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Formula: C18H18Cl2FN3S MolecularWeight: 398.325023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=S)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=S)NCC3=C(C=C(C=C3)Cl)Cl

InChI

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