N-(2-methylphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-4-phenyl-1,3-thiazol-2-imine

Systemtic Name: N-(2-methylphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-4-phenyl-1,3-thiazol-2-imine Openeye Name: 3-(3-morpholin-4-ium-4-ylpropyl)-N-(o-tolyl)-4-phenyl-thiazol-2-imine CAS Name: N-(2-methylphenyl)-3-[3-(4-morpholin-4-iumyl)propyl]-4-phenyl-2-thiazolimine IUPAC Name: N-(2-methylphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-4-phenyl-1,3-thiazol-2-imine Traditional Name: [3-(3-morpholin-4-ium-4-ylpropyl)-4-phenyl-4-thiazolin-2-ylidene]-(o-tolyl)amine Formula: C23H28N3OS+ MolecularWeight: 394.55292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=C2N(C(=CS2)C3=CC=CC=C3)CCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1N=C2N(C(=CS2)C3=CC=CC=C3)CCC[NH+]4CCOCC4

InChI

InChI=1S/C23H27N3OS/c1-19-8-5-6-11-21(19)24-23-26(13-7-12-25-14-16-27-17-15-25)22(18-28-23)20-9-3-2-4-10-20/h2-6,8-11,18H,7,12-17H2,1H3/p+1