ethyl 5-ethyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[3-(4-isopropylphenyl)prop-2-enoylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(3-p-cumenylacryloyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO3S MolecularWeight: 371.4931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C=CC2=CC=C(C=C2)C(C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C=CC2=CC=C(C=C2)C(C)C)C(=O)OCC

InChI

InChI=1S/C21H25NO3S/c1-5-17-13-18(21(24)25-6-2)20(26-17)22-19(23)12-9-15-7-10-16(11-8-15)14(3)4/h7-14H,5-6H2,1-4H3,(H,22,23)