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

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzyl-4-[(3-chloro-4-fluoro-phenyl)methyl]piperazine-1-carbothioamide CAS Name: 4-[(3-chloro-4-fluorophenyl)methyl]-N-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-[(3-chloro-4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-benzyl-4-(3-chloro-4-fluoro-benzyl)piperazine-1-carbothioamide Formula: C19H21ClFN3S MolecularWeight: 377.906543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClFN3S/c20-17-12-16(6-7-18(17)21)14-23-8-10-24(11-9-23)19(25)22-13-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2,(H,22,25)