N-[3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]phenyl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]phenyl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[3-[4-(2,5-dimethylphenyl)thiazol-2-yl]phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[3-[4-(2,5-dimethylphenyl)-2-thiazolyl]phenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]phenyl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[3-[4-(2,5-dimethylphenyl)thiazol-2-yl]phenyl]-2-morpholin-4-ium-4-yl-acetamide Formula: C23H26N3O2S+ MolecularWeight: 408.53644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=N2)C3=CC(=CC=C3)NC(=O)C[NH+]4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=N2)C3=CC(=CC=C3)NC(=O)C[NH+]4CCOCC4

InChI

InChI=1S/C23H25N3O2S/c1-16-6-7-17(2)20(12-16)21-15-29-23(25-21)18-4-3-5-19(13-18)24-22(27)14-26-8-10-28-11-9-26/h3-7,12-13,15H,8-11,14H2,1-2H3,(H,24,27)/p+1