ethyl 4-methyl-5-(methylcarbamoyl)-2-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[(4-oxo-3-phenyl-phthalazine-1-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[oxo-(4-oxo-3-phenyl-1-phthalazinyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[(4-oxo-3-phenylphthalazine-1-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(4-keto-3-phenyl-phthalazine-1-carbonyl)amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H22N4O5S MolecularWeight: 490.53098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O5S/c1-4-34-25(33)18-14(2)20(22(31)26-3)35-23(18)27-21(30)19-16-12-8-9-13-17(16)24(32)29(28-19)15-10-6-5-7-11-15/h5-13H,4H2,1-3H3,(H,26,31)(H,27,30)