3-(4-oxidanyl-1-phenyl-butan-2-yl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(4-oxidanyl-1-phenyl-butan-2-yl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-(1-benzyl-3-hydroxy-propyl)-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-(4-hydroxy-1-phenylbutan-2-yl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 3-(4-hydroxy-1-phenylbutan-2-yl)-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-(1-benzyl-3-hydroxy-propyl)-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C17H17N3O2S MolecularWeight: 327.40078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCO)N2C(=O)C3=C(NC2=S)N=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(CCO)N2C(=O)C3=C(NC2=S)N=CC=C3

InChI

InChI=1S/C17H17N3O2S/c21-10-8-13(11-12-5-2-1-3-6-12)20-16(22)14-7-4-9-18-15(14)19-17(20)23/h1-7,9,13,21H,8,10-11H2,(H,18,19,23)