4,5-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide CAS Name: 4,5-dimethyl-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide Formula: C18H24N3O3S2+ MolecularWeight: 394.53146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=C(SC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C18H23N3O3S2/c1-13-14(2)25-12-17(13)18(22)19-15-4-6-16(7-5-15)26(23,24)21-10-8-20(3)9-11-21/h4-7,12H,8-11H2,1-3H3,(H,19,22)/p+1