2-cyanopropan-2-yl 2-azanyl-3-(2-chlorophenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: 2-cyanopropan-2-yl 2-azanyl-3-(2-chlorophenyl)carbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: (1-cyano-1-methyl-ethyl) 2-amino-3-(2-chlorobenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-amino-3-[(2-chlorophenyl)-oxomethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-cyanopropan-2-yl ester IUPAC Name: 2-cyanopropan-2-yl 2-amino-3-(2-chlorobenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-amino-3-(2-chlorobenzoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid (1-cyano-1-methyl-ethyl) ester Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)OC(=O)N1CCC2=C(C1)SC(=C2C(=O)C3=CC=CC=C3Cl)N

Isomeric SMILES

CC(C)(C#N)OC(=O)N1CCC2=C(C1)SC(=C2C(=O)C3=CC=CC=C3Cl)N

InChI

InChI=1S/C19H18ClN3O3S/c1-19(2,10-21)26-18(25)23-8-7-12-14(9-23)27-17(22)15(12)16(24)11-5-3-4-6-13(11)20/h3-6H,7-9,22H2,1-2H3