methyl 3-[(6-chloranyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(6-chloranyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[6-chloro-2-(3-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[6-chloro-2-(3-pyridinyl)-4-quinolinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(6-chloro-2-pyridin-3-ylquinoline-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[[6-chloro-2-(3-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C21H14ClN3O3S MolecularWeight: 423.87216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C21H14ClN3O3S/c1-28-21(27)19-17(6-8-29-19)25-20(26)15-10-18(12-3-2-7-23-11-12)24-16-5-4-13(22)9-14(15)16/h2-11H,1H3,(H,25,26)