ethyl 5-aminocarbonyl-4-methyl-2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-[[(E)-3-(4-isopropylphenyl)prop-2-enoyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[(E)-3-p-cumenylacryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C=CC2=CC=C(C=C2)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4S/c1-5-27-21(26)17-13(4)18(19(22)25)28-20(17)23-16(24)11-8-14-6-9-15(10-7-14)12(2)3/h6-12H,5H2,1-4H3,(H2,22,25)(H,23,24)/b11-8+