4-(3,4-dimethoxyphenyl)-3-(3-morpholin-4-ylpropyl)-N-phenyl-1,3-thiazol-3-ium-2-amine

Systemtic Name: 4-(3,4-dimethoxyphenyl)-3-(3-morpholin-4-ylpropyl)-N-phenyl-1,3-thiazol-3-ium-2-amine Openeye Name: 4-(3,4-dimethoxyphenyl)-3-(3-morpholinopropyl)-N-phenyl-thiazol-3-ium-2-amine CAS Name: 4-(3,4-dimethoxyphenyl)-3-[3-(4-morpholinyl)propyl]-N-phenyl-2-thiazol-3-iumamine IUPAC Name: 4-(3,4-dimethoxyphenyl)-3-(3-morpholin-4-ylpropyl)-N-phenyl-1,3-thiazol-3-ium-2-amine Traditional Name: [4-(3,4-dimethoxyphenyl)-3-(3-morpholinopropyl)thiazol-3-ium-2-yl]-phenyl-amine Formula: C24H30N3O3S+ MolecularWeight: 440.5783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=[N+]2CCCN3CCOCC3)NC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=[N+]2CCCN3CCOCC3)NC4=CC=CC=C4)OC

InChI

InChI=1S/C24H29N3O3S/c1-28-22-10-9-19(17-23(22)29-2)21-18-31-24(25-20-7-4-3-5-8-20)27(21)12-6-11-26-13-15-30-16-14-26/h3-5,7-10,17-18H,6,11-16H2,1-2H3/p+1