ethyl 5-ethyl-2-[(8-methyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[(8-methyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[8-methyl-2-(3-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[8-methyl-2-(3-pyridinyl)-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(8-methyl-2-pyridin-3-ylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[8-methyl-2-(3-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CN=CC=C4)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CN=CC=C4)C(=O)OCC

InChI

InChI=1S/C25H23N3O3S/c1-4-17-12-20(25(30)31-5-2)24(32-17)28-23(29)19-13-21(16-9-7-11-26-14-16)27-22-15(3)8-6-10-18(19)22/h6-14H,4-5H2,1-3H3,(H,28,29)