[4-(thiophen-2-ylcarbonylamino)phenyl] 3-(2,4-dimethylphenyl)propanoate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 3-(2,4-dimethylphenyl)propanoate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 3-(2,4-dimethylphenyl)propanoate CAS Name: 3-(2,4-dimethylphenyl)propanoic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 3-(2,4-dimethylphenyl)propanoate Traditional Name: 3-(2,4-dimethylphenyl)propionic acid [4-(2-thenoylamino)phenyl] ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C

InChI

InChI=1S/C22H21NO3S/c1-15-5-6-17(16(2)14-15)7-12-21(24)26-19-10-8-18(9-11-19)23-22(25)20-4-3-13-27-20/h3-6,8-11,13-14H,7,12H2,1-2H3,(H,23,25)