2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-(2-phenylphenyl)benzamide

Systemtic Name: 2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-(2-phenylphenyl)benzamide Openeye Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-(2-phenylphenyl)benzamide CAS Name: 2-chloro-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]-N-(2-phenylphenyl)benzamide IUPAC Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-(2-phenylphenyl)benzamide Traditional Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-(2-phenylphenyl)benzamide Formula: C25H27ClN3O3S+ MolecularWeight: 485.01818

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C25H26ClN3O3S/c1-2-28-14-16-29(17-15-28)33(31,32)20-12-13-23(26)22(18-20)25(30)27-24-11-7-6-10-21(24)19-8-4-3-5-9-19/h3-13,18H,2,14-17H2,1H3,(H,27,30)/p+1