N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(4-morpholinylsulfonyl)phenyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonylphenyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-2-keto-1H-quinoline-4-carboxamide Formula: C26H32N5O5S+ MolecularWeight: 526.62778

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=O)NC5=CC=CC=C54

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=O)NC5=CC=CC=C54

InChI

InChI=1S/C26H31N5O5S/c1-2-29-9-11-30(12-10-29)24-8-7-19(37(34,35)31-13-15-36-16-14-31)17-23(24)28-26(33)21-18-25(32)27-22-6-4-3-5-20(21)22/h3-8,17-18H,2,9-16H2,1H3,(H,27,32)(H,28,33)/p+1