3-[3-(2-ethylpiperidin-1-ium-1-yl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[3-(2-ethylpiperidin-1-ium-1-yl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-[3-(2-ethylpiperidin-1-ium-1-yl)propyl]-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(2-ethyl-1-piperidin-1-iumyl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 3-[3-(2-ethylpiperidin-1-ium-1-yl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-(2-ethylpiperidin-1-ium-1-yl)propyl]-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C17H25N4OS+ MolecularWeight: 333.4716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CCCN2C(=O)C3=C(NC2=S)N=CC=C3

Isomeric SMILES

CCC1CCCC[NH+]1CCCN2C(=O)C3=C(NC2=S)N=CC=C3

InChI

InChI=1S/C17H24N4OS/c1-2-13-7-3-4-10-20(13)11-6-12-21-16(22)14-8-5-9-18-15(14)19-17(21)23/h5,8-9,13H,2-4,6-7,10-12H2,1H3,(H,18,19,23)/p+1