3-methoxy-N-[1-(3-phenylsulfanylpropanoyl)piperidin-4-yl]benzamide

Systemtic Name: 3-methoxy-N-[1-(3-phenylsulfanylpropanoyl)piperidin-4-yl]benzamide Openeye Name: 3-methoxy-N-[1-(3-phenylsulfanylpropanoyl)-4-piperidyl]benzamide CAS Name: 3-methoxy-N-[1-[1-oxo-3-(phenylthio)propyl]-4-piperidinyl]benzamide IUPAC Name: 3-methoxy-N-[1-(3-phenylsulfanylpropanoyl)piperidin-4-yl]benzamide Traditional Name: 3-methoxy-N-[1-[3-(phenylthio)propanoyl]-4-piperidyl]benzamide Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2CCN(CC2)C(=O)CCSC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2CCN(CC2)C(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3S/c1-27-19-7-5-6-17(16-19)22(26)23-18-10-13-24(14-11-18)21(25)12-15-28-20-8-3-2-4-9-20/h2-9,16,18H,10-15H2,1H3,(H,23,26)