ethyl 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]-4-cyclopropyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]-4-cyclopropyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]-4-cyclopropyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-1-oxoprop-2-enyl]amino]-4-cyclopropyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoyl]amino]-4-cyclopropylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acryloyl]amino]-4-cyclopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)C=CC3=CC(=C(C=C3)OCC#N)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)/C=C/C3=CC(=C(C=C3)OCC#N)OC

InChI

InChI=1S/C22H22N2O5S/c1-3-28-22(26)20-16(15-6-7-15)13-30-21(20)24-19(25)9-5-14-4-8-17(29-11-10-23)18(12-14)27-2/h4-5,8-9,12-13,15H,3,6-7,11H2,1-2H3,(H,24,25)/b9-5+