[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl 4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxylate

Systemtic Name: [2-(furan-2-yl)-1,3-thiazol-4-yl]methyl 4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxylate Openeye Name: [2-(2-furyl)thiazol-4-yl]methyl 3-benzyl-4-oxo-phthalazine-1-carboxylate CAS Name: 4-oxo-3-(phenylmethyl)-1-phthalazinecarboxylic acid [2-(2-furanyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(furan-2-yl)-1,3-thiazol-4-yl]methyl 3-benzyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-benzyl-4-keto-phthalazine-1-carboxylic acid [2-(2-furyl)thiazol-4-yl]methyl ester Formula: C24H17N3O4S MolecularWeight: 443.47448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)OCC4=CSC(=N4)C5=CC=CO5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)OCC4=CSC(=N4)C5=CC=CO5

InChI

InChI=1S/C24H17N3O4S/c28-23-19-10-5-4-9-18(19)21(26-27(23)13-16-7-2-1-3-8-16)24(29)31-14-17-15-32-22(25-17)20-11-6-12-30-20/h1-12,15H,13-14H2