N-[2-(2,4-dichlorophenyl)ethyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(2,4-dichlorophenyl)ethyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(2,4-dichlorophenyl)ethyl]-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2,4-dichlorophenyl)ethyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(2,4-dichlorophenyl)ethyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(2,4-dichlorophenyl)ethyl]-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C21H21Cl2N3O2 MolecularWeight: 418.31634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3O2/c1-13(2)12-26-21(28)17-6-4-3-5-16(17)19(25-26)20(27)24-10-9-14-7-8-15(22)11-18(14)23/h3-8,11,13H,9-10,12H2,1-2H3,(H,24,27)