(1-oxidanidylpyridin-1-ium-3-yl)-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: (1-oxidanidylpyridin-1-ium-3-yl)-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone Openeye Name: (1-oxidopyridin-1-ium-3-yl)-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: (1-oxido-3-pyridin-1-iumyl)-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (1-oxidopyridin-1-ium-3-yl)-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: (1-oxidopyridin-1-ium-3-yl)-[4-(2-thenoyl)piperazino]methanone Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C[N+](=CC=C2)[O-])C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)C2=C[N+](=CC=C2)[O-])C(=O)C3=CC=CS3

InChI

InChI=1S/C15H15N3O3S/c19-14(12-3-1-5-18(21)11-12)16-6-8-17(9-7-16)15(20)13-4-2-10-22-13/h1-5,10-11H,6-9H2