4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-N-(3-ethoxypropyl)piperidine-1-carbothioamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-N-(3-ethoxypropyl)piperidine-1-carbothioamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-N-(3-ethoxypropyl)piperidine-1-carbothioamide CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-N-(3-ethoxypropyl)-1-piperidinecarbothioamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-N-(3-ethoxypropyl)piperidine-1-carbothioamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-N-(3-ethoxypropyl)piperidine-1-carbothioamide Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N1CCC(CC1)C(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOCCCNC(=S)N1CCC(CC1)C(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H28N2O4S/c1-2-24-11-3-8-21-20(27)22-9-6-15(7-10-22)19(23)16-4-5-17-18(14-16)26-13-12-25-17/h4-5,14-15H,2-3,6-13H2,1H3,(H,21,27)