N-[2-(4-chlorophenyl)sulfanyl-5-(4-propylpiperazin-1-yl)carbonyl-phenyl]ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanyl-5-(4-propylpiperazin-1-yl)carbonyl-phenyl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanyl-5-(4-propylpiperazine-1-carbonyl)phenyl]acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]-5-[oxo-(4-propyl-1-piperazinyl)methyl]phenyl]acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanyl-5-(4-propylpiperazine-1-carbonyl)phenyl]acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]-5-(4-propylpiperazine-1-carbonyl)phenyl]acetamide Formula: C22H26ClN3O2S MolecularWeight: 431.97874

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)NC(=O)C

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)NC(=O)C

InChI

InChI=1S/C22H26ClN3O2S/c1-3-10-25-11-13-26(14-12-25)22(28)17-4-9-21(20(15-17)24-16(2)27)29-19-7-5-18(23)6-8-19/h4-9,15H,3,10-14H2,1-2H3,(H,24,27)