N-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-2-(3-cyanoquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-2-(3-cyanoquinolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[(3-cyano-2-quinolyl)sulfanyl]-N-(2,4-dioxo-1H-pyrimidin-5-yl)acetamide CAS Name: 2-[(3-cyano-2-quinolinyl)thio]-N-(2,4-dioxo-1H-pyrimidin-5-yl)acetamide IUPAC Name: 2-(3-cyanoquinolin-2-yl)sulfanyl-N-(2,4-dioxo-1H-pyrimidin-5-yl)acetamide Traditional Name: 2-[(3-cyano-2-quinolyl)thio]-N-(2,4-diketo-1H-pyrimidin-5-yl)acetamide Formula: C16H11N5O3S MolecularWeight: 353.35524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CNC(=O)NC3=O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CNC(=O)NC3=O)C#N

InChI

InChI=1S/C16H11N5O3S/c17-6-10-5-9-3-1-2-4-11(9)20-15(10)25-8-13(22)19-12-7-18-16(24)21-14(12)23/h1-5,7H,8H2,(H,19,22)(H2,18,21,23,24)