N-[4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonylphenyl]furan-2-carboxamide

Systemtic Name: N-[4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonylphenyl]furan-2-carboxamide Openeye Name: N-[4-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonylphenyl]furan-2-carboxamide CAS Name: N-[4-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]sulfonyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonylphenyl]furan-2-carboxamide Traditional Name: N-[4-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-furamide Formula: C28H28N3O4S+ MolecularWeight: 502.60462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C28H27N3O4S/c32-28(26-12-7-21-35-26)29-24-13-15-25(16-14-24)36(33,34)31-19-17-30(18-20-31)27(22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-16,21,27H,17-20H2,(H,29,32)/p+1