N-[2-oxidanylidene-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]naphthalene-2-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]naphthalene-2-carboxamide Openeye Name: N-[2-oxo-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]naphthalene-2-carboxamide CAS Name: N-[2-oxo-2-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazin-4-iumyl]ethyl]-2-naphthalenecarboxamide IUPAC Name: N-[2-oxo-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]naphthalene-2-carboxamide Traditional Name: N-[2-keto-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]-2-naphthamide Formula: C27H27N4O2S+ MolecularWeight: 471.59388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CNC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CNC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H26N4O2S/c32-25(17-28-26(33)23-11-10-20-6-4-5-9-22(20)16-23)31-14-12-30(13-15-31)18-24-19-34-27(29-24)21-7-2-1-3-8-21/h1-11,16,19H,12-15,17-18H2,(H,28,33)/p+1