ethyl 2-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-cyano-3-[4-(diethylamino)phenyl]-1-oxoprop-2-enyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-cyano-3-[4-(diethylamino)phenyl]acryloyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C27H27N3O3S/c1-4-30(5-2)22-14-12-19(13-15-22)16-21(17-28)25(31)29-26-24(27(32)33-6-3)23(18-34-26)20-10-8-7-9-11-20/h7-16,18H,4-6H2,1-3H3,(H,29,31)