2-(carboxycarbonylamino)-6-(quinolin-2-ylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid

Systemtic Name: 2-(carboxycarbonylamino)-6-(quinolin-2-ylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Openeye Name: 2-(oxaloamino)-6-(2-quinolylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid CAS Name: 2-(oxaloamino)-6-(2-quinolinylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid IUPAC Name: 2-(oxaloamino)-6-(quinolin-2-ylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Traditional Name: 2-(oxaloamino)-6-(2-quinolylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H17N3O5S/c24-17(20(27)28)22-18-16(19(25)26)13-7-8-23(10-15(13)29-18)9-12-6-5-11-3-1-2-4-14(11)21-12/h1-6H,7-10H2,(H,22,24)(H,25,26)(H,27,28)