[2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-2-oxidanylidene-ethyl]-[(5-methylthiophen-2-yl)methyl]-phenethyl-azanium

Systemtic Name: [2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-2-oxidanylidene-ethyl]-[(5-methylthiophen-2-yl)methyl]-phenethyl-azanium Openeye Name: [2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]-2-oxo-ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium CAS Name: [2-[[2-methyl-2-(4-morpholin-4-iumyl)propyl]amino]-2-oxoethyl]-[(5-methyl-2-thiophenyl)methyl]-phenethylammonium IUPAC Name: [2-[(2-methyl-2-morpholin-4-ium-4-ylpropyl)amino]-2-oxoethyl]-[(5-methylthiophen-2-yl)methyl]-phenethylazanium Traditional Name: [2-keto-2-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)amino]ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium Formula: C24H37N3O2S+2 MolecularWeight: 431.63448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NCC(C)(C)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NCC(C)(C)[NH+]3CCOCC3

InChI

InChI=1S/C24H35N3O2S/c1-20-9-10-22(30-20)17-26(12-11-21-7-5-4-6-8-21)18-23(28)25-19-24(2,3)27-13-15-29-16-14-27/h4-10H,11-19H2,1-3H3,(H,25,28)/p+2