2-[(3,4-dichlorophenyl)methylsulfanyl]-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]ethanamide

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]ethanamide Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-N-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]acetamide IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide Formula: C26H25Cl2N3O2S MolecularWeight: 514.4666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)CSCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)CSCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H25Cl2N3O2S/c27-22-11-10-19(16-23(22)28)17-34-18-25(32)29-24-9-5-4-8-21(24)26(33)31-14-12-30(13-15-31)20-6-2-1-3-7-20/h1-11,16H,12-15,17-18H2,(H,29,32)