N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-ethanoylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-ethanoylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-(3-chloro-4-fluoro-phenyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-(3-chloro-4-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-(3-chloro-4-fluorophenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-(3-chloro-4-fluoro-phenyl)piperazine-1-carbothioamide Formula: C19H19ClFN3OS MolecularWeight: 391.890063

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H19ClFN3OS/c1-13(25)14-2-5-16(6-3-14)23-8-10-24(11-9-23)19(26)22-15-4-7-18(21)17(20)12-15/h2-7,12H,8-11H2,1H3,(H,22,26)