3-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: 3-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(pyridin-2-ylmethyl)propanamide Openeye Name: 3-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(2-pyridylmethyl)propanamide CAS Name: 3-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(2-pyridinylmethyl)propanamide IUPAC Name: 3-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(pyridin-2-ylmethyl)propanamide Traditional Name: 3-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(2-pyridylmethyl)propionamide Formula: C15H14N4O2S2 MolecularWeight: 346.42726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)CCN2C(=O)C3=C(C=CS3)NC2=S

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)CCN2C(=O)C3=C(C=CS3)NC2=S

InChI

InChI=1S/C15H14N4O2S2/c20-12(17-9-10-3-1-2-6-16-10)4-7-19-14(21)13-11(5-8-23-13)18-15(19)22/h1-3,5-6,8H,4,7,9H2,(H,17,20)(H,18,22)