N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide

Systemtic Name: N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-[4-(4-ethylphenyl)thiazol-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-[4-(4-ethylphenyl)-2-thiazolyl]-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-[4-(4-ethylphenyl)thiazol-2-yl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C23H26N3O2S+ MolecularWeight: 408.53644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)C[NH+]4CCOCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)C[NH+]4CCOCC4

InChI

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