[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate

Systemtic Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate Openeye Name: [2-(4-chlorophenyl)thiazol-4-yl]methyl 2-(4-carbamoyl-1-oxo-phthalazin-2-yl)acetate CAS Name: 2-(4-carbamoyl-1-oxo-2-phthalazinyl)acetic acid [2-(4-chlorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(4-carbamoyl-1-oxophthalazin-2-yl)acetate Traditional Name: 2-(4-carbamoyl-1-keto-phthalazin-2-yl)acetic acid [2-(4-chlorophenyl)thiazol-4-yl]methyl ester Formula: C21H15ClN4O4S MolecularWeight: 454.8862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)Cl)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)Cl)C(=O)N

InChI

InChI=1S/C21H15ClN4O4S/c22-13-7-5-12(6-8-13)20-24-14(11-31-20)10-30-17(27)9-26-21(29)16-4-2-1-3-15(16)18(25-26)19(23)28/h1-8,11H,9-10H2,(H2,23,28)