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

Systemtic Name: N-[2-(4-chlorophenyl)sulfanyl-5-(4-ethylpiperazin-1-yl)carbonyl-phenyl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanyl-5-(4-ethylpiperazine-1-carbonyl)phenyl]acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]-5-[(4-ethyl-1-piperazinyl)-oxomethyl]phenyl]acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanyl-5-(4-ethylpiperazine-1-carbonyl)phenyl]acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]-5-(4-ethylpiperazine-1-carbonyl)phenyl]acetamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)NC(=O)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)NC(=O)C

InChI

InChI=1S/C21H24ClN3O2S/c1-3-24-10-12-25(13-11-24)21(27)16-4-9-20(19(14-16)23-15(2)26)28-18-7-5-17(22)6-8-18/h4-9,14H,3,10-13H2,1-2H3,(H,23,26)