5-phenyl-4-[[1-(phenylmethyl)piperidin-4-yl]carbamoylamino]pentanethioate

Systemtic Name: 5-phenyl-4-[[1-(phenylmethyl)piperidin-4-yl]carbamoylamino]pentanethioate Openeye Name: 4-[(1-benzyl-4-piperidyl)carbamoylamino]-5-phenyl-pentanethioate CAS Name: 4-[[oxo-[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]amino]-5-phenylpentanethioate IUPAC Name: 4-[(1-benzylpiperidin-4-yl)carbamoylamino]-5-phenylpentanethioate Traditional Name: 4-[(1-benzyl-4-piperidyl)carbamoylamino]-5-phenyl-thiovalerate Formula: C24H30N3O2S- MolecularWeight: 424.5789

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC(CCC(=S)[O-])CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)NC(CCC(=S)[O-])CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2S/c28-23(30)12-11-22(17-19-7-3-1-4-8-19)26-24(29)25-21-13-15-27(16-14-21)18-20-9-5-2-6-10-20/h1-10,21-22H,11-18H2,(H,28,30)(H2,25,26,29)/p-1