N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C23H21ClN4OS MolecularWeight: 436.95704

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21ClN4OS/c24-18-9-10-20(19(16-18)22(29)17-6-2-1-3-7-17)26-23(30)28-14-12-27(13-15-28)21-8-4-5-11-25-21/h1-11,16H,12-15H2,(H,26,30)