ethyl 3-(4-chlorophenyl)-5-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 3-(4-chlorophenyl)-5-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 3-(4-chlorophenyl)-5-[(4-morpholinosulfonylbenzoyl)amino]-4-oxo-thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 3-(4-chlorophenyl)-5-[[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorophenyl)-5-[(4-morpholin-4-ylsulfonylbenzoyl)amino]-4-oxothieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 3-(4-chlorophenyl)-4-keto-5-[(4-morpholinosulfonylbenzoyl)amino]thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C26H23ClN4O7S2 MolecularWeight: 603.06642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H23ClN4O7S2/c1-2-38-26(34)22-20-15-39-24(21(20)25(33)31(29-22)18-7-5-17(27)6-8-18)28-23(32)16-3-9-19(10-4-16)40(35,36)30-11-13-37-14-12-30/h3-10,15H,2,11-14H2,1H3,(H,28,32)