N-[4-methoxy-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)phenyl]ethanamide

Systemtic Name: N-[4-methoxy-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)phenyl]ethanamide Openeye Name: N-[4-methoxy-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)phenyl]acetamide CAS Name: N-[4-methoxy-3-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-methoxy-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)phenyl]acetamide Traditional Name: N-[4-methoxy-3-(2-morpholin-4-ium-4-ylethylthiocarbamoylamino)phenyl]acetamide Formula: C16H25N4O3S+ MolecularWeight: 353.4597

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C16H24N4O3S/c1-12(21)18-13-3-4-15(22-2)14(11-13)19-16(24)17-5-6-20-7-9-23-10-8-20/h3-4,11H,5-10H2,1-2H3,(H,18,21)(H2,17,19,24)/p+1