methyl-[(4-methylsulfanylphenyl)methyl]-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-(1-naphthylamino)-2-oxo-ethyl]ammonium CAS Name: methyl-[[4-(methylthio)phenyl]methyl]-[2-(1-naphthalenylamino)-2-oxoethyl]ammonium IUPAC Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-(naphthalen-1-ylamino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(1-naphthylamino)ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C21H23N2OS+ MolecularWeight: 351.48512

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H22N2OS/c1-23(14-16-10-12-18(25-2)13-11-16)15-21(24)22-20-9-5-7-17-6-3-4-8-19(17)20/h3-13H,14-15H2,1-2H3,(H,22,24)/p+1