methyl 2-[(6-chloranyl-2-pyridin-4-yl-quinolin-4-yl)carbonylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(6-chloranyl-2-pyridin-4-yl-quinolin-4-yl)carbonylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[6-chloro-2-(4-pyridyl)quinoline-4-carbonyl]amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(6-chloro-2-pyridin-4-yl-4-quinolinyl)-oxomethyl]amino]-5-[diethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(6-chloro-2-pyridin-4-ylquinoline-4-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[[6-chloro-2-(4-pyridyl)quinoline-4-carbonyl]amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C27H25ClN4O4S MolecularWeight: 537.0298

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=NC=C4)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=NC=C4)C(=O)OC)C

InChI

InChI=1S/C27H25ClN4O4S/c1-5-32(6-2)26(34)23-15(3)22(27(35)36-4)25(37-23)31-24(33)19-14-21(16-9-11-29-12-10-16)30-20-8-7-17(28)13-18(19)20/h7-14H,5-6H2,1-4H3,(H,31,33)