[2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [2-[(3-chlorophenyl)methylamino]-2-oxo-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [2-[(3-chlorophenyl)methylamino]-2-oxoethyl]-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [2-[(3-chlorophenyl)methylamino]-2-oxoethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [2-[(3-chlorobenzyl)amino]-2-keto-ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C18H22ClN2OS+ MolecularWeight: 349.89808

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NCC2=CC(=CC=C2)Cl

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H21ClN2OS/c1-21(12-14-6-8-17(23-2)9-7-14)13-18(22)20-11-15-4-3-5-16(19)10-15/h3-10H,11-13H2,1-2H3,(H,20,22)/p+1