methyl 2-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-phenylprop-2-enyl]amino]-4-(4-ethylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-phenylprop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-phenyl-acryloyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C(=CC3=CC=CC=C3)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)/C(=C/C3=CC=CC=C3)/C#N

InChI

InChI=1S/C24H20N2O3S/c1-3-16-9-11-18(12-10-16)20-15-30-23(21(20)24(28)29-2)26-22(27)19(14-25)13-17-7-5-4-6-8-17/h4-13,15H,3H2,1-2H3,(H,26,27)/b19-13+