[3-(dimethylsulfamoyl)phenyl]methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: [3-(dimethylsulfamoyl)phenyl]methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: [3-(dimethylsulfamoyl)phenyl]methyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid [3-(dimethylsulfamoyl)phenyl]methyl ester IUPAC Name: [3-(dimethylsulfamoyl)phenyl]methyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid [3-(dimethylsulfamoyl)benzyl] ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H23N3O5S/c1-4-12-24-20(25)18-11-6-5-10-17(18)19(22-24)21(26)29-14-15-8-7-9-16(13-15)30(27,28)23(2)3/h5-11,13H,4,12,14H2,1-3H3