N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-ethyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-ethyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-ethyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethyl-4-oxo-3-propyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-ethyl-4-oxo-3-propylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethyl-4-keto-3-propyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC4=C(C=C3)OCCO4)SC(=C2)CC

Isomeric SMILES

CCCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC4=C(C=C3)OCCO4)SC(=C2)CC

InChI

InChI=1S/C21H23N3O4S2/c1-3-7-24-20(26)15-11-14(4-2)30-19(15)23-21(24)29-12-18(25)22-13-5-6-16-17(10-13)28-9-8-27-16/h5-6,10-11H,3-4,7-9,12H2,1-2H3,(H,22,25)