N-[3-bromanyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]-3-[(5-ethynylthiophen-2-yl)carbonylamino]oxolane-3-carboxamide

Systemtic Name: N-[3-bromanyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]-3-[(5-ethynylthiophen-2-yl)carbonylamino]oxolane-3-carboxamide Openeye Name: N-[3-bromo-4-(3-oxomorpholin-4-yl)phenyl]-3-[(5-ethynylthiophene-2-carbonyl)amino]tetrahydrofuran-3-carboxamide CAS Name: N-[3-bromo-4-(3-oxo-4-morpholinyl)phenyl]-3-[[(5-ethynyl-2-thiophenyl)-oxomethyl]amino]-3-oxolanecarboxamide IUPAC Name: N-[3-bromo-4-(3-oxomorpholin-4-yl)phenyl]-3-[(5-ethynylthiophene-2-carbonyl)amino]oxolane-3-carboxamide Traditional Name: N-[3-bromo-4-(3-ketomorpholino)phenyl]-3-[(5-ethynylthiophene-2-carbonyl)amino]tetrahydrofuran-3-carboxamide Formula: C22H20BrN3O5S MolecularWeight: 518.3803

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(S1)C(=O)NC2(CCOC2)C(=O)NC3=CC(=C(C=C3)N4CCOCC4=O)Br

Isomeric SMILES

C#CC1=CC=C(S1)C(=O)NC2(CCOC2)C(=O)NC3=CC(=C(C=C3)N4CCOCC4=O)Br

InChI

InChI=1S/C22H20BrN3O5S/c1-2-15-4-6-18(32-15)20(28)25-22(7-9-31-13-22)21(29)24-14-3-5-17(16(23)11-14)26-8-10-30-12-19(26)27/h1,3-6,11H,7-10,12-13H2,(H,24,29)(H,25,28)