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

Systemtic Name: 5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide Openeye Name: 5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide CAS Name: 5-methyl-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-3-thiophenecarboxamide IUPAC Name: 5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide Traditional Name: 5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thiophene-3-carboxamide Formula: C17H22N3O3S2+ MolecularWeight: 380.50488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CS1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=CS1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H21N3O3S2/c1-13-11-14(12-24-13)17(21)18-15-3-5-16(6-4-15)25(22,23)20-9-7-19(2)8-10-20/h3-6,11-12H,7-10H2,1-2H3,(H,18,21)/p+1