methyl 3-cyano-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: methyl 3-cyano-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 3-cyano-2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-cyano-2-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-cyano-2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-cyano-2-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H17N3O5S/c1-25-19(24)22-5-4-12-13(9-20)18(28-16(12)10-22)21-17(23)11-2-3-14-15(8-11)27-7-6-26-14/h2-3,8H,4-7,10H2,1H3,(H,21,23)