ethyl 2-[(2,5-dimethylphenyl)carbonylamino]-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 2-[(2,5-dimethylphenyl)carbonylamino]-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: ethyl 2-[(2,5-dimethylbenzoyl)amino]-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[[(2,5-dimethylphenyl)-oxomethyl]amino]-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,5-dimethylbenzoyl)amino]-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-[(2,5-dimethylbenzoyl)amino]-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCN1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H28N2O3S/c1-5-10-24-11-9-16-18(13-24)28-21(19(16)22(26)27-6-2)23-20(25)17-12-14(3)7-8-15(17)4/h7-8,12H,5-6,9-11,13H2,1-4H3,(H,23,25)