3-butyl-N-[4-(methylcarbamoyl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[4-(methylcarbamoyl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[4-(methylcarbamoyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[4-(methylcarbamoyl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[4-(methylcarbamoyl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-[4-(methylcarbamoyl)phenyl]phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)NC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)NC

InChI

InChI=1S/C21H22N4O3/c1-3-4-13-25-21(28)17-8-6-5-7-16(17)18(24-25)20(27)23-15-11-9-14(10-12-15)19(26)22-2/h5-12H,3-4,13H2,1-2H3,(H,22,26)(H,23,27)