(4-pyridin-1-ium-2-ylpiperazin-1-yl)-thiophen-2-yl-methanone

Systemtic Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-thiophen-2-yl-methanone Openeye Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(2-thienyl)methanone CAS Name: [4-(2-pyridin-1-iumyl)-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-thiophen-2-ylmethanone Traditional Name: (4-pyridin-1-ium-2-ylpiperazino)-(2-thienyl)methanone Formula: C14H16N3OS+ MolecularWeight: 274.36134

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=CS3

InChI

InChI=1S/C14H15N3OS/c18-14(12-4-3-11-19-12)17-9-7-16(8-10-17)13-5-1-2-6-15-13/h1-6,11H,7-10H2/p+1