N-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide

Systemtic Name: N-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide Openeye Name: N-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]ethylcarbamothioyl]benzamide CAS Name: N-[[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidinyl]ethylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethylcarbamothioyl]benzamide Traditional Name: N-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]ethylthiocarbamoyl]benzamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNC(=S)NC(=O)C2=CC=CC=C2)CC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCC1CCNC(=S)NC(=O)C2=CC=CC=C2)CC3COC4=CC=CC=C4O3

InChI

InChI=1S/C24H29N3O3S/c28-23(19-6-2-1-3-7-19)26-24(31)25-13-10-18-11-14-27(15-12-18)16-20-17-29-21-8-4-5-9-22(21)30-20/h1-9,18,20H,10-17H2,(H2,25,26,28,31)