propan-2-yl 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: isopropyl 2-[[(E)-2-cyano-3-(4-isobutoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(4-isobutoxyphenyl)acryloyl]amino]thiophene-3-carboxylic acid isopropyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CS2)C(=O)OC(C)C

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=CS2)C(=O)OC(C)C

InChI

InChI=1S/C22H24N2O4S/c1-14(2)13-27-18-7-5-16(6-8-18)11-17(12-23)20(25)24-21-19(9-10-29-21)22(26)28-15(3)4/h5-11,14-15H,13H2,1-4H3,(H,24,25)/b17-11+