N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxidanylidene-3-phenyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxidanylidene-3-phenyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-oxo-3-phenyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-oxo-3-phenyl-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-keto-3-phenyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C26H19N3O4S3 MolecularWeight: 533.64176

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3C6=CC=CC=C6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3C6=CC=CC=C6

InChI

InChI=1S/C26H19N3O4S3/c30-22(27-16-8-9-19-20(13-16)33-11-10-32-19)15-36-26-28-24-23(18(14-35-24)21-7-4-12-34-21)25(31)29(26)17-5-2-1-3-6-17/h1-9,12-14H,10-11,15H2,(H,27,30)