ethyl 2-[[(E)-2-cyano-3-(5-morpholin-4-ylfuran-2-yl)prop-2-enoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-(5-morpholin-4-ylfuran-2-yl)prop-2-enoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-2-cyano-3-(5-morpholino-2-furyl)prop-2-enoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[5-(4-morpholinyl)-2-furanyl]-1-oxoprop-2-enyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-(5-morpholin-4-ylfuran-2-yl)prop-2-enoyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(5-morpholino-2-furyl)acryloyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(=CC2=CC=C(O2)N3CCOCC3)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)/C(=C/C2=CC=C(O2)N3CCOCC3)/C#N

InChI

InChI=1S/C21H23N3O5S/c1-4-28-21(26)18-13(2)14(3)30-20(18)23-19(25)15(12-22)11-16-5-6-17(29-16)24-7-9-27-10-8-24/h5-6,11H,4,7-10H2,1-3H3,(H,23,25)/b15-11+