2-methoxy-N-[1-(phenethylcarbamothioyl)piperidin-4-yl]benzamide

Systemtic Name: 2-methoxy-N-[1-(phenethylcarbamothioyl)piperidin-4-yl]benzamide Openeye Name: 2-methoxy-N-[1-(phenethylcarbamothioyl)-4-piperidyl]benzamide CAS Name: 2-methoxy-N-[1-[(phenethylamino)-sulfanylidenemethyl]-4-piperidinyl]benzamide IUPAC Name: 2-methoxy-N-[1-(phenethylcarbamothioyl)piperidin-4-yl]benzamide Traditional Name: 2-methoxy-N-[1-(phenethylthiocarbamoyl)-4-piperidyl]benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2CCN(CC2)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2CCN(CC2)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2S/c1-27-20-10-6-5-9-19(20)21(26)24-18-12-15-25(16-13-18)22(28)23-14-11-17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3,(H,23,28)(H,24,26)