N-cyclopropyl-2-[4-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[2-[(2,5-diphenyl-3-pyrazolyl)amino]-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C26H31N6O2+ MolecularWeight: 459.56334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC(=NN3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC(=NN3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H30N6O2/c33-25(27-21-11-12-21)18-30-13-15-31(16-14-30)19-26(34)28-24-17-23(20-7-3-1-4-8-20)29-32(24)22-9-5-2-6-10-22/h1-10,17,21H,11-16,18-19H2,(H,27,33)(H,28,34)/p+1