N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(phenoxymethyl)furan-2-carboxamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(phenoxymethyl)furan-2-carboxamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(phenoxymethyl)furan-2-carboxamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-3-(phenoxymethyl)-2-furancarboxamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(phenoxymethyl)furan-2-carboxamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(phenoxymethyl)-2-furamide Formula: C23H26N3O5S+ MolecularWeight: 456.53464

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CO3)COC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CO3)COC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O5S/c1-25-12-14-26(15-13-25)32(28,29)21-9-7-19(8-10-21)24-23(27)22-18(11-16-30-22)17-31-20-5-3-2-4-6-20/h2-11,16H,12-15,17H2,1H3,(H,24,27)/p+1