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

Systemtic Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(4-morpholin-4-iumyl)propyl]-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C14H19N4O2S+ MolecularWeight: 307.39126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C(=O)C3=C(NC2=S)N=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCCN2C(=O)C3=C(NC2=S)N=CC=C3

InChI

InChI=1S/C14H18N4O2S/c19-13-11-3-1-4-15-12(11)16-14(21)18(13)6-2-5-17-7-9-20-10-8-17/h1,3-4H,2,5-10H2,(H,15,16,21)/p+1