methyl 5-methyl-2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)C(=O)OC

InChI

InChI=1S/C22H17N3O3S/c1-13-11-17(22(27)28-2)21(29-13)25-20(26)16-12-19(14-7-9-23-10-8-14)24-18-6-4-3-5-15(16)18/h3-12H,1-2H3,(H,25,26)