(2-methoxy-5-methyl-phenyl)methyl-methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl-methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (2-methoxy-5-methyl-phenyl)methyl-methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxo-ethyl]ammonium CAS Name: (2-methoxy-5-methylphenyl)methyl-methyl-[2-[methyl-[[4-(methylthio)phenyl]methyl]amino]-2-oxoethyl]ammonium IUPAC Name: (2-methoxy-5-methylphenyl)methyl-methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[methyl-[4-(methylthio)benzyl]amino]ethyl]-(2-methoxy-5-methyl-benzyl)-methyl-ammonium Formula: C21H29N2O2S+ MolecularWeight: 373.53216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+](C)CC(=O)N(C)CC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+](C)CC(=O)N(C)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C21H28N2O2S/c1-16-6-11-20(25-4)18(12-16)14-22(2)15-21(24)23(3)13-17-7-9-19(26-5)10-8-17/h6-12H,13-15H2,1-5H3/p+1