2-methyl-5-[[4-methyl-5-(2-phenoxyethyl)-1,3-thiazol-3-ium-3-yl]methyl]-N,N-diphenyl-pyrimidin-4-amine chloride

Systemtic Name: 2-methyl-5-[[4-methyl-5-(2-phenoxyethyl)-1,3-thiazol-3-ium-3-yl]methyl]-N,N-diphenyl-pyrimidin-4-amine chloride Openeye Name: 2-methyl-5-[[4-methyl-5-(2-phenoxyethyl)thiazol-3-ium-3-yl]methyl]-N,N-diphenyl-pyrimidin-4-amine chloride CAS Name: 2-methyl-5-[[4-methyl-5-(2-phenoxyethyl)-3-thiazol-3-iumyl]methyl]-N,N-diphenyl-4-pyrimidinamine chloride IUPAC Name: 2-methyl-5-[[4-methyl-5-(2-phenoxyethyl)-1,3-thiazol-3-ium-3-yl]methyl]-N,N-diphenylpyrimidin-4-amine chloride Traditional Name: [2-methyl-5-[[4-methyl-5-(2-phenoxyethyl)thiazol-3-ium-3-yl]methyl]pyrimidin-4-yl]-diphenyl-amine chloride Formula: C30H29ClN4OS MolecularWeight: 529.09546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC2=CN=C(N=C2N(C3=CC=CC=C3)C4=CC=CC=C4)C)CCOC5=CC=CC=C5.[Cl-]

Isomeric SMILES

CC1=C(SC=[N+]1CC2=CN=C(N=C2N(C3=CC=CC=C3)C4=CC=CC=C4)C)CCOC5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C30H29N4OS.ClH/c1-23-29(18-19-35-28-16-10-5-11-17-28)36-22-33(23)21-25-20-31-24(2)32-30(25)34(26-12-6-3-7-13-26)27-14-8-4-9-15-27;/h3-17,20,22H,18-19,21H2,1-2H3;1H/q+1;/p-1