(E)-3-[3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]-2-thiophen-2-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]-2-thiophen-2-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-[3-methoxy-4-(2-morpholino-2-oxo-ethoxy)phenyl]-2-(thiophene-2-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[3-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]-2-[oxo(thiophen-2-yl)methyl]-2-propenenitrile IUPAC Name: (E)-3-[3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-2-(thiophene-2-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[4-(2-keto-2-morpholino-ethoxy)-3-methoxy-phenyl]-2-(2-thenoyl)acrylonitrile Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC=CS2)OCC(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=CS2)OCC(=O)N3CCOCC3

InChI

InChI=1S/C21H20N2O5S/c1-26-18-12-15(11-16(13-22)21(25)19-3-2-10-29-19)4-5-17(18)28-14-20(24)23-6-8-27-9-7-23/h2-5,10-12H,6-9,14H2,1H3/b16-11+