ethyl 4-[(3-ethyl-2-methyl-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(3-ethyl-2-methyl-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(3-ethyl-2-methyl-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbonyl)amino]benzoate CAS Name: 4-[[(3-ethyl-2-methyl-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-ethyl-2-methyl-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbonyl)amino]benzoate Traditional Name: 4-[(3-ethyl-2-methyl-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carbonyl)amino]benzoic acid ethyl ester Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1CCN(C2C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCC)C

Isomeric SMILES

CCC1=C(SC2=C1CCN(C2C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCC)C

InChI

InChI=1S/C26H28N2O3S/c1-4-21-17(3)32-24-22(21)15-16-28(23(24)18-9-7-6-8-10-18)26(30)27-20-13-11-19(12-14-20)25(29)31-5-2/h6-14,23H,4-5,15-16H2,1-3H3,(H,27,30)