[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl-methyl-[4-(methylthio)benzyl]ammonium Formula: C21H25N2O2S2+ MolecularWeight: 401.5654

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H24N2O2S2/c1-23(12-15-5-8-18(26-4)9-6-15)13-17-14-27-21(22-17)16-7-10-19(24-2)20(11-16)25-3/h5-11,14H,12-13H2,1-4H3/p+1