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

Systemtic Name: methyl 3-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C16H13N3O4S/c1-19-15(21)10-6-4-3-5-9(10)12(18-19)14(20)17-11-7-8-24-13(11)16(22)23-2/h3-8H,1-2H3,(H,17,20)