4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-N-methyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-N-methyl-piperazine-1-carbothioamide CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)-N-methyl-piperazine-1-carbothioamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCN(CC1)C(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CNC(=S)N1CCN(CC1)C(=O)C2COC3=CC=CC=C3O2

InChI

InChI=1S/C15H19N3O3S/c1-16-15(22)18-8-6-17(7-9-18)14(19)13-10-20-11-4-2-3-5-12(11)21-13/h2-5,13H,6-10H2,1H3,(H,16,22)