N-(1-phenyl-3-sulfanyl-propan-2-yl)-4-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: N-(1-phenyl-3-sulfanyl-propan-2-yl)-4-propan-2-yl-piperazine-1-carboxamide Openeye Name: N-(1-benzyl-2-sulfanyl-ethyl)-4-isopropyl-piperazine-1-carboxamide CAS Name: N-(1-mercapto-3-phenylpropan-2-yl)-4-propan-2-yl-1-piperazinecarboxamide IUPAC Name: N-(1-phenyl-3-sulfanylpropan-2-yl)-4-propan-2-ylpiperazine-1-carboxamide Traditional Name: N-(1-benzyl-2-mercapto-ethyl)-4-isopropyl-piperazine-1-carboxamide Formula: C17H27N3OS MolecularWeight: 321.48078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)CS

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)NC(CC2=CC=CC=C2)CS

InChI

InChI=1S/C17H27N3OS/c1-14(2)19-8-10-20(11-9-19)17(21)18-16(13-22)12-15-6-4-3-5-7-15/h3-7,14,16,22H,8-13H2,1-2H3,(H,18,21)