N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbothioylfuran-2-carboxamide

Systemtic Name: N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbothioylfuran-2-carboxamide Openeye Name: N-(4-pyridin-1-ium-2-ylpiperazine-1-carbothioyl)furan-2-carboxamide CAS Name: N-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-(4-pyridin-1-ium-2-ylpiperazine-1-carbothioyl)furan-2-carboxamide Traditional Name: N-(4-pyridin-1-ium-2-ylpiperazine-1-carbothioyl)-2-furamide Formula: C15H17N4O2S+ MolecularWeight: 317.38608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=S)NC(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=S)NC(=O)C3=CC=CO3

InChI

InChI=1S/C15H16N4O2S/c20-14(12-4-3-11-21-12)17-15(22)19-9-7-18(8-10-19)13-5-1-2-6-16-13/h1-6,11H,7-10H2,(H,17,20,22)/p+1