2-[4-(2-methylsulfanylphenyl)carbonylpiperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(2-methylsulfanylphenyl)carbonylpiperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-(2-methylsulfanylbenzoyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[[2-(methylthio)phenyl]-oxomethyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(2-methylsulfanylbenzoyl)piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-[2-(methylthio)benzoyl]piperazino]acetamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCN(CC1)C(=O)C2=CC=CC=C2SC

Isomeric SMILES

CC(C)NC(=O)CN1CCN(CC1)C(=O)C2=CC=CC=C2SC

InChI

InChI=1S/C17H25N3O2S/c1-13(2)18-16(21)12-19-8-10-20(11-9-19)17(22)14-6-4-5-7-15(14)23-3/h4-7,13H,8-12H2,1-3H3,(H,18,21)