4-[[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]methyl]-N-phenyl-1,3-thiazol-2-amine

Systemtic Name: 4-[[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]methyl]-N-phenyl-1,3-thiazol-2-amine Openeye Name: 4-[[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]methyl]-N-phenyl-thiazol-2-amine CAS Name: 4-[[4-(1-naphthalenylmethyl)-1-piperazin-1-iumyl]methyl]-N-phenyl-2-thiazolamine IUPAC Name: 4-[[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]methyl]-N-phenyl-1,3-thiazol-2-amine Traditional Name: [4-[[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]-phenyl-amine Formula: C25H27N4S+ MolecularWeight: 415.57368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC(=N2)NC3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC(=N2)NC3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H26N4S/c1-2-10-22(11-3-1)26-25-27-23(19-30-25)18-29-15-13-28(14-16-29)17-21-9-6-8-20-7-4-5-12-24(20)21/h1-12,19H,13-18H2,(H,26,27)/p+1