2-[(4-chlorophenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzenecarboximidate

Systemtic Name: 2-[(4-chlorophenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzenecarboximidate Openeye Name: 2-[(4-chlorophenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzenecarboximidate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]benzenecarboximidate IUPAC Name: 2-[(4-chlorophenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzenecarboximidate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzenecarboximidate Formula: C25H27ClN4O3S MolecularWeight: 499.02488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCN=C(C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCN=C(C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl)[O-])C4=CC=CC=C4

InChI

InChI=1S/C25H27ClN4O3S/c26-20-10-12-22(13-11-20)34(32,33)28-24-9-5-4-8-23(24)25(31)27-14-15-29-16-18-30(19-17-29)21-6-2-1-3-7-21/h1-13,28H,14-19H2,(H,27,31)