4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-thiophen-2-yl-1,3-oxazole

Systemtic Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-thiophen-2-yl-1,3-oxazole Openeye Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-(2-thienyl)oxazole CAS Name: 4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-thiophen-2-yloxazole IUPAC Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-thiophen-2-yl-1,3-oxazole Traditional Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-(2-thienyl)oxazole Formula: C18H20N3OS+ MolecularWeight: 326.4359

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=COC(=N2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=COC(=N2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C18H19N3OS/c1-2-5-16(6-3-1)21-10-8-20(9-11-21)13-15-14-22-18(19-15)17-7-4-12-23-17/h1-7,12,14H,8-11,13H2/p+1