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

Systemtic Name: 3-[3-(2-methylpiperidin-1-ium-1-yl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-[3-(2-methylpiperidin-1-ium-1-yl)propyl]-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(2-methyl-1-piperidin-1-iumyl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 3-[3-(2-methylpiperidin-1-ium-1-yl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-(2-methylpiperidin-1-ium-1-yl)propyl]-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C16H23N4OS+ MolecularWeight: 319.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCN2C(=O)C3=C(NC2=S)N=CC=C3

Isomeric SMILES

CC1CCCC[NH+]1CCCN2C(=O)C3=C(NC2=S)N=CC=C3

InChI

InChI=1S/C16H22N4OS/c1-12-6-2-3-9-19(12)10-5-11-20-15(21)13-7-4-8-17-14(13)18-16(20)22/h4,7-8,12H,2-3,5-6,9-11H2,1H3,(H,17,18,22)/p+1