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

Systemtic Name: 4-(4-ethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-N-phenyl-1,3-thiazol-2-imine Openeye Name: 4-(4-ethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-N-phenyl-thiazol-2-imine CAS Name: 4-(4-ethoxyphenyl)-3-[3-(4-morpholin-4-iumyl)propyl]-N-phenyl-2-thiazolimine IUPAC Name: 4-(4-ethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-N-phenyl-1,3-thiazol-2-imine Traditional Name: [3-(3-morpholin-4-ium-4-ylpropyl)-4-p-phenetyl-4-thiazolin-2-ylidene]-phenyl-amine Formula: C24H30N3O2S+ MolecularWeight: 424.5789

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=NC3=CC=CC=C3)N2CCC[NH+]4CCOCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=NC3=CC=CC=C3)N2CCC[NH+]4CCOCC4

InChI

InChI=1S/C24H29N3O2S/c1-2-29-22-11-9-20(10-12-22)23-19-30-24(25-21-7-4-3-5-8-21)27(23)14-6-13-26-15-17-28-18-16-26/h3-5,7-12,19H,2,6,13-18H2,1H3/p+1