[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]-propyl-azanium

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]-propyl-azanium Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl]-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]-propyl-ammonium CAS Name: [2-(2-methylanilino)-2-oxoethyl]-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]-propylammonium IUPAC Name: [2-(2-methylanilino)-2-oxoethyl]-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]-propylazanium Traditional Name: [2-keto-2-(o-toluidino)ethyl]-[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]-propyl-ammonium Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC(=O)NCCC1=CC=CS1)CC(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCC[NH+](CC(=O)NCCC1=CC=CS1)CC(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C20H27N3O2S/c1-3-12-23(14-19(24)21-11-10-17-8-6-13-26-17)15-20(25)22-18-9-5-4-7-16(18)2/h4-9,13H,3,10-12,14-15H2,1-2H3,(H,21,24)(H,22,25)/p+1