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

Systemtic Name: 4-phenethyl-N-(1-phenyl-3-sulfanyl-propan-2-yl)piperazine-1-carboxamide Openeye Name: N-(1-benzyl-2-sulfanyl-ethyl)-4-phenethyl-piperazine-1-carboxamide CAS Name: N-(1-mercapto-3-phenylpropan-2-yl)-4-phenethyl-1-piperazinecarboxamide IUPAC Name: 4-phenethyl-N-(1-phenyl-3-sulfanylpropan-2-yl)piperazine-1-carboxamide Traditional Name: N-(1-benzyl-2-mercapto-ethyl)-4-phenethyl-piperazine-1-carboxamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)CS

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)CS

InChI

InChI=1S/C22H29N3OS/c26-22(23-21(18-27)17-20-9-5-2-6-10-20)25-15-13-24(14-16-25)12-11-19-7-3-1-4-8-19/h1-10,21,27H,11-18H2,(H,23,26)