N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-pyrazol-1-yl-benzamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-pyrazol-1-yl-benzamide Formula: C22H26N5O+ MolecularWeight: 376.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H25N5O/c1-2-25-14-16-26(17-15-25)21-7-4-3-6-20(21)24-22(28)18-8-10-19(11-9-18)27-13-5-12-23-27/h3-13H,2,14-17H2,1H3,(H,24,28)/p+1