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

Systemtic Name: 4-butoxy-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]benzamide Openeye Name: N-[(1-benzyl-4-piperidyl)carbamothioyl]-4-butoxy-benzamide CAS Name: 4-butoxy-N-[[[1-(phenylmethyl)-4-piperidinyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(1-benzylpiperidin-4-yl)carbamothioyl]-4-butoxybenzamide Traditional Name: N-[(1-benzyl-4-piperidyl)thiocarbamoyl]-4-butoxy-benzamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2S/c1-2-3-17-29-22-11-9-20(10-12-22)23(28)26-24(30)25-21-13-15-27(16-14-21)18-19-7-5-4-6-8-19/h4-12,21H,2-3,13-18H2,1H3,(H2,25,26,28,30)