N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)oxy]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-acetamide Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)COC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)COC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5)OC1

InChI

InChI=1S/C23H19N3O4S/c27-21(26-16-7-8-18-19(11-16)29-10-4-9-28-18)13-30-22-17-12-20(15-5-2-1-3-6-15)31-23(17)25-14-24-22/h1-3,5-8,11-12,14H,4,9-10,13H2,(H,26,27)