N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide

Systemtic Name: N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide Openeye Name: N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide CAS Name: N-[5-(4-ethylphenyl)-2-phenyl-3-pyrazolyl]-2-(4-methyl-1-piperazine-1,4-diiumyl)acetamide IUPAC Name: N-[5-(4-ethylphenyl)-2-phenylpyrazol-3-yl]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Traditional Name: N-[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Formula: C24H31N5O+2 MolecularWeight: 405.53584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)C[NH+]3CC[NH+](CC3)C)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)C[NH+]3CC[NH+](CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C24H29N5O/c1-3-19-9-11-20(12-10-19)22-17-23(29(26-22)21-7-5-4-6-8-21)25-24(30)18-28-15-13-27(2)14-16-28/h4-12,17H,3,13-16,18H2,1-2H3,(H,25,30)/p+2