1-(1,2,3-benzothiadiazol-5-ylcarbamothioyl)-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: 1-(1,2,3-benzothiadiazol-5-ylcarbamothioyl)-N,N-diethyl-piperidine-3-carboxamide Openeye Name: 1-(1,2,3-benzothiadiazol-5-ylcarbamothioyl)-N,N-diethyl-piperidine-3-carboxamide CAS Name: 1-[(1,2,3-benzothiadiazol-5-ylamino)-sulfanylidenemethyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: 1-(1,2,3-benzothiadiazol-5-ylcarbamothioyl)-N,N-diethylpiperidine-3-carboxamide Traditional Name: 1-(1,2,3-benzothiadiazol-5-ylthiocarbamoyl)-N,N-diethyl-nipecotamide Formula: C17H23N5OS2 MolecularWeight: 377.52742

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)C(=S)NC2=CC3=C(C=C2)SN=N3

Isomeric SMILES

CCN(CC)C(=O)C1CCCN(C1)C(=S)NC2=CC3=C(C=C2)SN=N3

InChI

InChI=1S/C17H23N5OS2/c1-3-21(4-2)16(23)12-6-5-9-22(11-12)17(24)18-13-7-8-15-14(10-13)19-20-25-15/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,18,24)