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

Systemtic Name: N-(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-4-(4-phenoxyphenyl)-1,3-thiazol-3-ium-2-amine Openeye Name: 3-(2-morpholinoethyl)-4-(4-phenoxyphenyl)-N-(p-tolyl)thiazol-3-ium-2-amine CAS Name: N-(4-methylphenyl)-3-[2-(4-morpholinyl)ethyl]-4-(4-phenoxyphenyl)-2-thiazol-3-iumamine IUPAC Name: N-(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-4-(4-phenoxyphenyl)-1,3-thiazol-3-ium-2-amine Traditional Name: [3-(2-morpholinoethyl)-4-(4-phenoxyphenyl)thiazol-3-ium-2-yl]-(p-tolyl)amine Formula: C28H30N3O2S+ MolecularWeight: 472.6217

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)OC4=CC=CC=C4)CCN5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)OC4=CC=CC=C4)CCN5CCOCC5

InChI

InChI=1S/C28H29N3O2S/c1-22-7-11-24(12-8-22)29-28-31(16-15-30-17-19-32-20-18-30)27(21-34-28)23-9-13-26(14-10-23)33-25-5-3-2-4-6-25/h2-14,21H,15-20H2,1H3/p+1