ethyl 4-(4-ethylphenyl)-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-ethylphenyl)-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-ethylphenyl)-2-[3-(4-isopropylphenyl)prop-2-enoylamino]thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-[[1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylphenyl)-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-2-[(3-p-cumenylacryloyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C27H29NO3S MolecularWeight: 447.58906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C=CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C=CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C27H29NO3S/c1-5-19-7-14-22(15-8-19)23-17-32-26(25(23)27(30)31-6-2)28-24(29)16-11-20-9-12-21(13-10-20)18(3)4/h7-18H,5-6H2,1-4H3,(H,28,29)