[2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [2-(N-acetylanilino)thiazol-4-yl]methyl 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid [2-(N-acetylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetylanilino)-1,3-thiazol-4-yl]methyl 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid [2-(N-acetylanilino)thiazol-4-yl]methyl ester Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)N(C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)N(C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C23H20N4O4S/c1-3-26-21(29)19-12-8-7-11-18(19)20(25-26)22(30)31-13-16-14-32-23(24-16)27(15(2)28)17-9-5-4-6-10-17/h4-12,14H,3,13H2,1-2H3