methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-6-pyrazin-2-ylcarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-6-pyrazin-2-ylcarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-6-(pyrazine-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-6-[oxo(2-pyrazinyl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-6-(pyrazine-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-6-pyrazinoyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C23H22N4O5S2 MolecularWeight: 498.57458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3=NC=CN=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3=NC=CN=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C23H22N4O5S2/c1-32-22(29)20-17-7-10-26(21(28)18-12-24-8-9-25-18)14-19(17)33-23(20)34(30,31)27-11-6-15-4-2-3-5-16(15)13-27/h2-5,8-9,12H,6-7,10-11,13-14H2,1H3