dimethyl-[3-[4-(4-methylphenyl)-2-phenylazanyl-1,3-thiazol-3-ium-3-yl]propyl]azanium

Systemtic Name: dimethyl-[3-[4-(4-methylphenyl)-2-phenylazanyl-1,3-thiazol-3-ium-3-yl]propyl]azanium Openeye Name: 3-[2-anilino-4-(p-tolyl)thiazol-3-ium-3-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-anilino-4-(4-methylphenyl)-3-thiazol-3-iumyl]propyl-dimethylammonium IUPAC Name: 3-[2-anilino-4-(4-methylphenyl)-1,3-thiazol-3-ium-3-yl]propyl-dimethylazanium Traditional Name: 3-[2-anilino-4-(p-tolyl)thiazol-3-ium-3-yl]propyl-dimethyl-ammonium Formula: C21H27N3S+2 MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=[N+]2CCC[NH+](C)C)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=[N+]2CCC[NH+](C)C)NC3=CC=CC=C3

InChI

InChI=1S/C21H25N3S/c1-17-10-12-18(13-11-17)20-16-25-21(22-19-8-5-4-6-9-19)24(20)15-7-14-23(2)3/h4-6,8-13,16H,7,14-15H2,1-3H3/p+2