ethyl-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[2-(4-methylphenyl)sulfanylethyl]azanium

Systemtic Name: ethyl-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[2-(4-methylphenyl)sulfanylethyl]azanium Openeye Name: ethyl-[2-(3-methoxyanilino)-2-oxo-ethyl]-[2-(p-tolylsulfanyl)ethyl]ammonium CAS Name: ethyl-[2-(3-methoxyanilino)-2-oxoethyl]-[2-[(4-methylphenyl)thio]ethyl]ammonium IUPAC Name: ethyl-[2-(3-methoxyanilino)-2-oxoethyl]-[2-(4-methylphenyl)sulfanylethyl]azanium Traditional Name: ethyl-[2-keto-2-(m-anisidino)ethyl]-[2-(p-tolylthio)ethyl]ammonium Formula: C20H27N2O2S+ MolecularWeight: 359.50558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCSC1=CC=C(C=C1)C)CC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC[NH+](CCSC1=CC=C(C=C1)C)CC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C20H26N2O2S/c1-4-22(12-13-25-19-10-8-16(2)9-11-19)15-20(23)21-17-6-5-7-18(14-17)24-3/h5-11,14H,4,12-13,15H2,1-3H3,(H,21,23)/p+1