N-[2,4-bis(fluoranyl)phenyl]-4-(2-chlorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(2-chlorophenyl)piperazine-1-carbothioamide Openeye Name: 4-(2-chlorophenyl)-N-(2,4-difluorophenyl)piperazine-1-carbothioamide CAS Name: 4-(2-chlorophenyl)-N-(2,4-difluorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2-chlorophenyl)-N-(2,4-difluorophenyl)piperazine-1-carbothioamide Traditional Name: 4-(2-chlorophenyl)-N-(2,4-difluorophenyl)piperazine-1-carbothioamide Formula: C17H16ClF2N3S MolecularWeight: 367.843846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=S)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=S)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C17H16ClF2N3S/c18-13-3-1-2-4-16(13)22-7-9-23(10-8-22)17(24)21-15-6-5-12(19)11-14(15)20/h1-6,11H,7-10H2,(H,21,24)