3,4-dimethoxy-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[2-[1-(phenylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide Openeye Name: N-[2-(1-benzyl-4-piperidyl)ethylcarbamothioyl]-3,4-dimethoxy-benzamide CAS Name: 3,4-dimethoxy-N-[[2-[1-(phenylmethyl)-4-piperidinyl]ethylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[2-(1-benzylpiperidin-4-yl)ethylcarbamothioyl]-3,4-dimethoxybenzamide Traditional Name: N-[2-(1-benzyl-4-piperidyl)ethylthiocarbamoyl]-3,4-dimethoxy-benzamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NCCC2CCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NCCC2CCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C24H31N3O3S/c1-29-21-9-8-20(16-22(21)30-2)23(28)26-24(31)25-13-10-18-11-14-27(15-12-18)17-19-6-4-3-5-7-19/h3-9,16,18H,10-15,17H2,1-2H3,(H2,25,26,28,31)