methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]azanium

Systemtic Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]azanium Openeye Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]ammonium CAS Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]ammonium IUPAC Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]azanium Traditional Name: [2-keto-2-[2-(2-thienyl)ethylamino]ethyl]-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C18H24N3O2S+ MolecularWeight: 346.46706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)C[NH+](C)CC(=O)NCCC2=CC=CS2

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)C[NH+](C)CC(=O)NCCC2=CC=CS2

InChI

InChI=1S/C18H23N3O2S/c1-19-18(23)15-7-5-14(6-8-15)12-21(2)13-17(22)20-10-9-16-4-3-11-24-16/h3-8,11H,9-10,12-13H2,1-2H3,(H,19,23)(H,20,22)/p+1