2-(4-methylpiperazin-1-yl)-N-(1-phenyl-3-sulfanyl-propan-2-yl)ethanamide

Systemtic Name: 2-(4-methylpiperazin-1-yl)-N-(1-phenyl-3-sulfanyl-propan-2-yl)ethanamide Openeye Name: N-(1-benzyl-2-sulfanyl-ethyl)-2-(4-methylpiperazin-1-yl)acetamide CAS Name: N-(1-mercapto-3-phenylpropan-2-yl)-2-(4-methyl-1-piperazinyl)acetamide IUPAC Name: 2-(4-methylpiperazin-1-yl)-N-(1-phenyl-3-sulfanylpropan-2-yl)acetamide Traditional Name: N-(1-benzyl-2-mercapto-ethyl)-2-(4-methylpiperazino)acetamide Formula: C16H25N3OS MolecularWeight: 307.4542

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)NC(CC2=CC=CC=C2)CS

Isomeric SMILES

CN1CCN(CC1)CC(=O)NC(CC2=CC=CC=C2)CS

InChI

InChI=1S/C16H25N3OS/c1-18-7-9-19(10-8-18)12-16(20)17-15(13-21)11-14-5-3-2-4-6-14/h2-6,15,21H,7-13H2,1H3,(H,17,20)