N-methyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonyl-thiophene-2-carboxamide

Systemtic Name: N-methyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonyl-thiophene-2-carboxamide Openeye Name: N-methyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonyl-thiophene-2-carboxamide CAS Name: N-methyl-4-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]sulfonyl]-2-thiophenecarboxamide IUPAC Name: N-methyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylthiophene-2-carboxamide Traditional Name: N-methyl-4-(4-pyridin-1-ium-2-ylpiperazino)sulfonyl-thiophene-2-carboxamide Formula: C15H19N4O3S2+ MolecularWeight: 367.46636

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CS1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CNC(=O)C1=CC(=CS1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C15H18N4O3S2/c1-16-15(20)13-10-12(11-23-13)24(21,22)19-8-6-18(7-9-19)14-4-2-3-5-17-14/h2-5,10-11H,6-9H2,1H3,(H,16,20)/p+1