3-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(phenylcarbonyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(phenylcarbonyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[benzoyl-[4-(4-methoxyphenyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[benzoyl-[4-(4-methoxyphenyl)-2-thiazolyl]amino]propyl-dimethylammonium IUPAC Name: 3-[benzoyl-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino]propyl-dimethylazanium Traditional Name: 3-[benzoyl-[4-(4-methoxyphenyl)thiazol-2-yl]amino]propyl-dimethyl-ammonium Formula: C22H26N3O2S+ MolecularWeight: 396.52574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2S/c1-24(2)14-7-15-25(21(26)18-8-5-4-6-9-18)22-23-20(16-28-22)17-10-12-19(27-3)13-11-17/h4-6,8-13,16H,7,14-15H2,1-3H3/p+1