N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-2-(4-chlorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-2-(4-chlorophenyl)sulfanyl-ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]acetamide CAS Name: N-[3-chloro-4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-2-[(4-chlorophenyl)thio]acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[3-chloro-4-(4-propionylpiperazino)phenyl]acetamide Formula: C21H23Cl2N3O2S MolecularWeight: 452.39722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O2S/c1-2-21(28)26-11-9-25(10-12-26)19-8-5-16(13-18(19)23)24-20(27)14-29-17-6-3-15(22)4-7-17/h3-8,13H,2,9-12,14H2,1H3,(H,24,27)