4-oxidanylidene-3-propan-2-yl-N-[2-(propylcarbamoyl)phenyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-propan-2-yl-N-[2-(propylcarbamoyl)phenyl]phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[2-(propylcarbamoyl)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[2-[oxo(propylamino)methyl]phenyl]-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propan-2-yl-N-[2-(propylcarbamoyl)phenyl]phthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[2-(propylcarbamoyl)phenyl]phthalazine-1-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

InChI

InChI=1S/C22H24N4O3/c1-4-13-23-20(27)17-11-7-8-12-18(17)24-21(28)19-15-9-5-6-10-16(15)22(29)26(25-19)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,23,27)(H,24,28)