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

Systemtic Name: methyl 5-propyl-2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-propyl-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 2-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]-5-propyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-propyl-2-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-propyl-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)C(=O)OC

InChI

InChI=1S/C24H21N3O3S/c1-3-6-16-13-19(24(29)30-2)23(31-16)27-22(28)18-14-21(15-9-11-25-12-10-15)26-20-8-5-4-7-17(18)20/h4-5,7-14H,3,6H2,1-2H3,(H,27,28)