8-(6-fluoranylpyridin-1-ium-2-yl)-N-(4-nitrophenyl)-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide

Systemtic Name: 8-(6-fluoranylpyridin-1-ium-2-yl)-N-(4-nitrophenyl)-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide Openeye Name: 8-(6-fluoropyridin-1-ium-2-yl)-N-(4-nitrophenyl)-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide CAS Name: 8-(6-fluoro-2-pyridin-1-iumyl)-N-(4-nitrophenyl)-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide IUPAC Name: 8-(6-fluoropyridin-1-ium-2-yl)-N-(4-nitrophenyl)-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide Traditional Name: 8-(6-fluoropyridin-1-ium-2-yl)-N-(4-nitrophenyl)-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide Formula: C19H21FN5O3S+ MolecularWeight: 418.465143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12N(CCO2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-])C4=[NH+]C(=CC=C4)F

Isomeric SMILES

C1CN(CCC12N(CCO2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-])C4=[NH+]C(=CC=C4)F

InChI

InChI=1S/C19H20FN5O3S/c20-16-2-1-3-17(22-16)23-10-8-19(9-11-23)24(12-13-28-19)18(29)21-14-4-6-15(7-5-14)25(26)27/h1-7H,8-13H2,(H,21,29)/p+1