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

Systemtic Name: ethyl 2-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]thiophene-3-carboxylate CAS Name: 2-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CS3)C(=O)OCC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CS3)C(=O)OCC

InChI

InChI=1S/C18H17N3O4S/c1-3-21-17(23)12-8-6-5-7-11(12)14(20-21)15(22)19-16-13(9-10-26-16)18(24)25-4-2/h5-10H,3-4H2,1-2H3,(H,19,22)