3-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-(2-methylphenyl)carbonyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-(2-methylphenyl)carbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-(2-methylbenzoyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-[(2-methylphenyl)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-(2-methylbenzoyl)amino]propyl-dimethylazanium Traditional Name: 3-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-o-toluoyl-amino]propyl-dimethyl-ammonium Formula: C24H30N3O3S+ MolecularWeight: 440.5783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N(CCC[NH+](C)C)C2=NC(=CS2)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)N(CCC[NH+](C)C)C2=NC(=CS2)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C24H29N3O3S/c1-17-9-6-7-10-19(17)23(28)27(14-8-13-26(2)3)24-25-21(16-31-24)20-15-18(29-4)11-12-22(20)30-5/h6-7,9-12,15-16H,8,13-14H2,1-5H3/p+1