4-acetamido-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]benzamide

Systemtic Name: 4-acetamido-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]benzamide Openeye Name: 4-acetamido-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]benzamide CAS Name: 4-acetamido-N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 4-acetamido-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonylphenyl]benzamide Traditional Name: 4-acetamido-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]benzamide Formula: C25H34N5O5S+ MolecularWeight: 516.63296

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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=C(C=C4)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C25H33N5O5S/c1-3-28-10-12-29(13-11-28)24-9-8-22(36(33,34)30-14-16-35-17-15-30)18-23(24)27-25(32)20-4-6-21(7-5-20)26-19(2)31/h4-9,18H,3,10-17H2,1-2H3,(H,26,31)(H,27,32)/p+1