N-(3-chloranyl-2-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-4-morpholin-4-yl-benzamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-4-morpholin-4-yl-benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-4-morpholino-benzamide CAS Name: N-(3-chloro-2-methylphenyl)-3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-4-(4-morpholinyl)benzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-4-morpholin-4-ylbenzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-4-morpholino-benzamide Formula: C23H30ClN4O4S+ MolecularWeight: 494.0267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)S(=O)(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)S(=O)(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C23H29ClN4O4S/c1-17-19(24)4-3-5-20(17)25-23(29)18-6-7-21(27-12-14-32-15-13-27)22(16-18)33(30,31)28-10-8-26(2)9-11-28/h3-7,16H,8-15H2,1-2H3,(H,25,29)/p+1