N-[3-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]carbonylnaphthalen-2-yl]cyclopropanecarboxamide

Systemtic Name: N-[3-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]carbonylnaphthalen-2-yl]cyclopropanecarboxamide Openeye Name: N-[3-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-4-ium-1-carbonyl]-2-naphthyl]cyclopropanecarboxamide CAS Name: N-[3-[oxo-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazin-4-iumyl]methyl]-2-naphthalenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide Traditional Name: N-[3-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-4-ium-1-carbonyl]-2-naphthyl]cyclopropanecarboxamide Formula: C29H29N4O2S+ MolecularWeight: 497.63116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC3=CC=CC=C3C=C2C(=O)N4CC[NH+](CC4)CC5=CSC(=N5)C6=CC=CC=C6

Isomeric SMILES

C1CC1C(=O)NC2=CC3=CC=CC=C3C=C2C(=O)N4CC[NH+](CC4)CC5=CSC(=N5)C6=CC=CC=C6

InChI

InChI=1S/C29H28N4O2S/c34-27(20-10-11-20)31-26-17-23-9-5-4-8-22(23)16-25(26)29(35)33-14-12-32(13-15-33)18-24-19-36-28(30-24)21-6-2-1-3-7-21/h1-9,16-17,19-20H,10-15,18H2,(H,31,34)/p+1