N,N-diethyl-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)benzamide

Systemtic Name: N,N-diethyl-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)benzamide Openeye Name: N,N-diethyl-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)benzamide CAS Name: N,N-diethyl-3-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N,N-diethyl-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)benzamide Traditional Name: N,N-diethyl-3-(2-morpholin-4-ium-4-ylethylthiocarbamoylamino)benzamide Formula: C18H29N4O2S+ MolecularWeight: 365.51346

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C18H28N4O2S/c1-3-22(4-2)17(23)15-6-5-7-16(14-15)20-18(25)19-8-9-21-10-12-24-13-11-21/h5-7,14H,3-4,8-13H2,1-2H3,(H2,19,20,25)/p+1