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

Systemtic Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [2-(2-methoxyphenyl)thiazol-4-yl]methyl 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid [2-(2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid [2-(2-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C24H23N3O4S MolecularWeight: 449.52212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4OC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4OC

InChI

InChI=1S/C24H23N3O4S/c1-3-4-13-27-23(28)18-10-6-5-9-17(18)21(26-27)24(29)31-14-16-15-32-22(25-16)19-11-7-8-12-20(19)30-2/h5-12,15H,3-4,13-14H2,1-2H3