N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(5-ethyl-4-phenyl-thiazol-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(5-ethyl-4-phenyl-2-thiazolyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(5-ethyl-4-phenyl-thiazol-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C23H27N4OS+ MolecularWeight: 407.55168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(N=C(S1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-2-20-22(18-9-5-3-6-10-18)25-23(29-20)24-21(28)17-26-13-15-27(16-14-26)19-11-7-4-8-12-19/h3-12H,2,13-17H2,1H3,(H,24,25,28)/p+1