N-tert-butyl-2-[4-[2-[(4-chlorophenyl)methylsulfanyl]ethanoyl]piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[(4-chlorophenyl)methylsulfanyl]ethanoyl]piperazin-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[(4-chlorophenyl)methylsulfanyl]acetyl]piperazin-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[(4-chlorophenyl)methylsulfanyl]acetyl]piperazin-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[(4-chlorobenzyl)thio]acetyl]piperazino]acetamide Formula: C19H28ClN3O2S MolecularWeight: 397.96252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCN(CC1)C(=O)CSCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCN(CC1)C(=O)CSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H28ClN3O2S/c1-19(2,3)21-17(24)12-22-8-10-23(11-9-22)18(25)14-26-13-15-4-6-16(20)7-5-15/h4-7H,8-14H2,1-3H3,(H,21,24)