N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-[2-(3-thienyl)thiazol-4-yl]acetamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]-2-[2-(3-thiophenyl)-4-thiazolyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-[2-(3-thienyl)thiazol-4-yl]acetamide Formula: C26H27N4OS2+ MolecularWeight: 475.64878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CC4=CSC(=N4)C5=CSC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CC4=CSC(=N4)C5=CSC=C5

InChI

InChI=1S/C26H26N4OS2/c31-25(16-23-19-33-26(28-23)21-10-15-32-18-21)27-22-6-8-24(9-7-22)30-13-11-29(12-14-30)17-20-4-2-1-3-5-20/h1-10,15,18-19H,11-14,16-17H2,(H,27,31)/p+1