3-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-(2-phenylethanoyl)amino]propyl-diethyl-azanium

Systemtic Name: 3-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-(2-phenylethanoyl)amino]propyl-diethyl-azanium Openeye Name: 3-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-(2-phenylacetyl)amino]propyl-diethyl-ammonium CAS Name: 3-[[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-(1-oxo-2-phenylethyl)amino]propyl-diethylammonium IUPAC Name: 3-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-(2-phenylacetyl)amino]propyl-diethylazanium Traditional Name: 3-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-(2-phenylacetyl)amino]propyl-diethyl-ammonium Formula: C26H34N3O3S+ MolecularWeight: 468.63146

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(C1=NC(=CS1)C2=C(C=CC(=C2)OC)OC)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCN(C1=NC(=CS1)C2=C(C=CC(=C2)OC)OC)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C26H33N3O3S/c1-5-28(6-2)15-10-16-29(25(30)17-20-11-8-7-9-12-20)26-27-23(19-33-26)22-18-21(31-3)13-14-24(22)32-4/h7-9,11-14,18-19H,5-6,10,15-17H2,1-4H3/p+1