N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-phenyl-1H-pyrazole-4-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-phenyl-1H-pyrazole-4-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-phenyl-1H-pyrazole-4-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-5-phenyl-1H-pyrazole-4-carboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-phenyl-1H-pyrazole-4-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-5-phenyl-1H-pyrazole-4-carboxamide Formula: C22H26N5O+ MolecularWeight: 376.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(NN=C3)C4=CC=CC=C4

InChI

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