5-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(pyridin-3-ylmethyl)pentanamide

Systemtic Name: 5-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(pyridin-3-ylmethyl)pentanamide Openeye Name: 5-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(3-pyridylmethyl)pentanamide CAS Name: 5-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(3-pyridinylmethyl)pentanamide IUPAC Name: 5-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(pyridin-3-ylmethyl)pentanamide Traditional Name: 5-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-(3-pyridylmethyl)valeramide Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)CCCCN2C(=O)C3=C(C=CS3)NC2=S

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)CCCCN2C(=O)C3=C(C=CS3)NC2=S

InChI

InChI=1S/C17H18N4O2S2/c22-14(19-11-12-4-3-7-18-10-12)5-1-2-8-21-16(23)15-13(6-9-25-15)20-17(21)24/h3-4,6-7,9-10H,1-2,5,8,11H2,(H,19,22)(H,20,24)