ethyl 4-oxidanylidene-5-[(4-phenylphenyl)carbonylamino]-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-5-[(4-phenylphenyl)carbonylamino]-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 4-oxo-5-[(4-phenylbenzoyl)amino]-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 4-oxo-5-[[oxo-(4-phenylphenyl)methyl]amino]-3-[4-(trifluoromethyl)phenyl]-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-5-[(4-phenylbenzoyl)amino]-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 4-keto-5-[(4-phenylbenzoyl)amino]-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C29H20F3N3O4S MolecularWeight: 563.54701

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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)C4=CC=CC=C4)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C29H20F3N3O4S/c1-2-39-28(38)24-22-16-40-26(33-25(36)19-10-8-18(9-11-19)17-6-4-3-5-7-17)23(22)27(37)35(34-24)21-14-12-20(13-15-21)29(30,31)32/h3-16H,2H2,1H3,(H,33,36)