methyl 3-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C21H15N3O3S/c1-27-21(26)19-17(8-11-28-19)24-20(25)15-12-18(13-6-9-22-10-7-13)23-16-5-3-2-4-14(15)16/h2-12H,1H3,(H,24,25)