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

Systemtic Name: 4-(2-hydroxyethyl)-N-(1-phenyl-3-sulfanyl-propan-2-yl)piperazine-1-carboxamide Openeye Name: N-(1-benzyl-2-sulfanyl-ethyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide CAS Name: 4-(2-hydroxyethyl)-N-(1-mercapto-3-phenylpropan-2-yl)-1-piperazinecarboxamide IUPAC Name: 4-(2-hydroxyethyl)-N-(1-phenyl-3-sulfanylpropan-2-yl)piperazine-1-carboxamide Traditional Name: N-(1-benzyl-2-mercapto-ethyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)NC(CC2=CC=CC=C2)CS

Isomeric SMILES

C1CN(CCN1CCO)C(=O)NC(CC2=CC=CC=C2)CS

InChI

InChI=1S/C16H25N3O2S/c20-11-10-18-6-8-19(9-7-18)16(21)17-15(13-22)12-14-4-2-1-3-5-14/h1-5,15,20,22H,6-13H2,(H,17,21)