3-[2-(4-chloranylphenoxy)ethanoyl-(4-phenyl-1,3-thiazol-2-yl)amino]propyl-diethyl-azanium

Systemtic Name: 3-[2-(4-chloranylphenoxy)ethanoyl-(4-phenyl-1,3-thiazol-2-yl)amino]propyl-diethyl-azanium Openeye Name: 3-[[2-(4-chlorophenoxy)acetyl]-(4-phenylthiazol-2-yl)amino]propyl-diethyl-ammonium CAS Name: 3-[[2-(4-chlorophenoxy)-1-oxoethyl]-(4-phenyl-2-thiazolyl)amino]propyl-diethylammonium IUPAC Name: 3-[[2-(4-chlorophenoxy)acetyl]-(4-phenyl-1,3-thiazol-2-yl)amino]propyl-diethylazanium Traditional Name: 3-[[2-(4-chlorophenoxy)acetyl]-(4-phenylthiazol-2-yl)amino]propyl-diethyl-ammonium Formula: C24H29ClN3O2S+ MolecularWeight: 459.02396

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

CC[NH+](CC)CCCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H28ClN3O2S/c1-3-27(4-2)15-8-16-28(23(29)17-30-21-13-11-20(25)12-14-21)24-26-22(18-31-24)19-9-6-5-7-10-19/h5-7,9-14,18H,3-4,8,15-17H2,1-2H3/p+1