3-[3-(dimethylamino)propylcarbamothioylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[3-(dimethylamino)propylcarbamothioylamino]-N,N-diethyl-benzamide Openeye Name: 3-[3-(dimethylamino)propylcarbamothioylamino]-N,N-diethyl-benzamide CAS Name: 3-[[[3-(dimethylamino)propylamino]-sulfanylidenemethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[3-(dimethylamino)propylcarbamothioylamino]-N,N-diethylbenzamide Traditional Name: 3-[3-(dimethylamino)propylthiocarbamoylamino]-N,N-diethyl-benzamide Formula: C17H28N4OS MolecularWeight: 336.49542

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=S)NCCCN(C)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=S)NCCCN(C)C

InChI

InChI=1S/C17H28N4OS/c1-5-21(6-2)16(22)14-9-7-10-15(13-14)19-17(23)18-11-8-12-20(3)4/h7,9-10,13H,5-6,8,11-12H2,1-4H3,(H2,18,19,23)