4-ethanoyl-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide

Systemtic Name: 4-ethanoyl-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide Openeye Name: 4-acetyl-N-[2-(1-benzyl-4-piperidyl)ethylcarbamothioyl]benzamide CAS Name: 4-acetyl-N-[[2-[1-(phenylmethyl)-4-piperidinyl]ethylamino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-acetyl-N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]benzamide Traditional Name: 4-acetyl-N-[2-(1-benzyl-4-piperidyl)ethylthiocarbamoyl]benzamide Formula: C24H29N3O2S MolecularWeight: 423.57096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)NC(=S)NCCC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)NC(=S)NCCC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O2S/c1-18(28)21-7-9-22(10-8-21)23(29)26-24(30)25-14-11-19-12-15-27(16-13-19)17-20-5-3-2-4-6-20/h2-10,19H,11-17H2,1H3,(H2,25,26,29,30)