N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)butyramide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CCCN3C(=O)C4=C(C=CS4)NC3=S

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CCCN3C(=O)C4=C(C=CS4)NC3=S

InChI

InChI=1S/C18H17N3O4S2/c22-15(19-11-3-4-13-14(10-11)25-8-7-24-13)2-1-6-21-17(23)16-12(5-9-27-16)20-18(21)26/h3-5,9-10H,1-2,6-8H2,(H,19,22)(H,20,26)