2-[(4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-butanamide

Systemtic Name: 2-[(4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-butanamide Openeye Name: 2-[(4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-butanamide CAS Name: 2-[(4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)thio]-N-phenylbutanamide IUPAC Name: 2-[(4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylbutanamide Traditional Name: 2-[(4-keto-3H-thieno[2,3-d]pyrimidin-2-yl)thio]-N-phenyl-butyramide Formula: C16H15N3O2S2 MolecularWeight: 345.4392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)SC2=NC3=C(C=CS3)C(=O)N2

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)SC2=NC3=C(C=CS3)C(=O)N2

InChI

InChI=1S/C16H15N3O2S2/c1-2-12(14(21)17-10-6-4-3-5-7-10)23-16-18-13(20)11-8-9-22-15(11)19-16/h3-9,12H,2H2,1H3,(H,17,21)(H,18,19,20)