5-chloranyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(4-morpholinylsulfonyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonylphenyl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]thiophene-2-carboxamide Formula: C21H28ClN4O4S2+ MolecularWeight: 500.05442

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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(S4)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H27ClN4O4S2/c1-2-24-7-9-25(10-8-24)18-4-3-16(32(28,29)26-11-13-30-14-12-26)15-17(18)23-21(27)19-5-6-20(22)31-19/h3-6,15H,2,7-14H2,1H3,(H,23,27)/p+1