4-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-1,3-oxazol-5-amine

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-1,3-oxazol-5-amine Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-4-(p-tolylsulfonyl)oxazol-5-amine CAS Name: 4-(4-methylphenyl)sulfonyl-N-[3-(4-morpholin-4-iumyl)propyl]-2-phenyl-5-oxazolamine IUPAC Name: 4-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-1,3-oxazol-5-amine Traditional Name: 3-morpholin-4-ium-4-ylpropyl-(2-phenyl-4-tosyl-oxazol-5-yl)amine Formula: C23H28N3O4S+ MolecularWeight: 442.55112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CC=C3)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CC=C3)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C23H27N3O4S/c1-18-8-10-20(11-9-18)31(27,28)23-22(24-12-5-13-26-14-16-29-17-15-26)30-21(25-23)19-6-3-2-4-7-19/h2-4,6-11,24H,5,12-17H2,1H3/p+1