ethyl 5-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[(2-chloro-5-morpholinosulfonyl-benzoyl)amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-1-(4-methyl-2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-chloro-5-morpholin-4-ylsulfonylbenzoyl)amino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate Traditional Name: 5-[(2-chloro-5-morpholinosulfonyl-benzoyl)amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C27H26ClN5O6S MolecularWeight: 584.04324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)Cl

InChI

InChI=1S/C27H26ClN5O6S/c1-3-39-27(35)21-16-29-33(24-14-17(2)19-6-4-5-7-23(19)30-24)25(21)31-26(34)20-15-18(8-9-22(20)28)40(36,37)32-10-12-38-13-11-32/h4-9,14-16H,3,10-13H2,1-2H3,(H,31,34)