4-(4-bromophenyl)-N-(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-1,3-thiazol-3-ium-2-amine

Systemtic Name: 4-(4-bromophenyl)-N-(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-1,3-thiazol-3-ium-2-amine Openeye Name: 4-(4-bromophenyl)-3-(2-morpholinoethyl)-N-(p-tolyl)thiazol-3-ium-2-amine CAS Name: 4-(4-bromophenyl)-N-(4-methylphenyl)-3-[2-(4-morpholinyl)ethyl]-2-thiazol-3-iumamine IUPAC Name: 4-(4-bromophenyl)-N-(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-1,3-thiazol-3-ium-2-amine Traditional Name: [4-(4-bromophenyl)-3-(2-morpholinoethyl)thiazol-3-ium-2-yl]-(p-tolyl)amine Formula: C22H25BrN3OS+ MolecularWeight: 459.4224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Br)CCN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Br)CCN4CCOCC4

InChI

InChI=1S/C22H24BrN3OS/c1-17-2-8-20(9-3-17)24-22-26(11-10-25-12-14-27-15-13-25)21(16-28-22)18-4-6-19(23)7-5-18/h2-9,16H,10-15H2,1H3/p+1