3-(3-piperidin-1-ium-1-ylpropyl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3-piperidin-1-ium-1-ylpropyl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-(3-piperidin-1-ium-1-ylpropyl)-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(1-piperidin-1-iumyl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 3-(3-piperidin-1-ium-1-ylpropyl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-piperidin-1-ium-1-ylpropyl)-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C15H21N4OS+ MolecularWeight: 305.41844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCN2C(=O)C3=C(NC2=S)N=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CCCN2C(=O)C3=C(NC2=S)N=CC=C3

InChI

InChI=1S/C15H20N4OS/c20-14-12-6-4-7-16-13(12)17-15(21)19(14)11-5-10-18-8-2-1-3-9-18/h4,6-7H,1-3,5,8-11H2,(H,16,17,21)/p+1