N-ethyl-4-[4-(2-phenylsulfanylethanoylamino)phenyl]piperazine-1-carboxamide

Systemtic Name: N-ethyl-4-[4-(2-phenylsulfanylethanoylamino)phenyl]piperazine-1-carboxamide Openeye Name: N-ethyl-4-[4-[(2-phenylsulfanylacetyl)amino]phenyl]piperazine-1-carboxamide CAS Name: N-ethyl-4-[4-[[1-oxo-2-(phenylthio)ethyl]amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-ethyl-4-[4-[(2-phenylsulfanylacetyl)amino]phenyl]piperazine-1-carboxamide Traditional Name: N-ethyl-4-[4-[[2-(phenylthio)acetyl]amino]phenyl]piperazine-1-carboxamide Formula: C21H26N4O2S MolecularWeight: 398.52174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O2S/c1-2-22-21(27)25-14-12-24(13-15-25)18-10-8-17(9-11-18)23-20(26)16-28-19-6-4-3-5-7-19/h3-11H,2,12-16H2,1H3,(H,22,27)(H,23,26)