2-(2-phenoxyethoxy)-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]benzamide

Systemtic Name: 2-(2-phenoxyethoxy)-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]benzamide Openeye Name: N-[(1-benzyl-4-piperidyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide CAS Name: 2-(2-phenoxyethoxy)-N-[[[1-(phenylmethyl)-4-piperidinyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(1-benzylpiperidin-4-yl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide Traditional Name: N-[(1-benzyl-4-piperidyl)thiocarbamoyl]-2-(2-phenoxyethoxy)benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O3S/c32-27(25-13-7-8-14-26(25)34-20-19-33-24-11-5-2-6-12-24)30-28(35)29-23-15-17-31(18-16-23)21-22-9-3-1-4-10-22/h1-14,23H,15-21H2,(H2,29,30,32,35)