3-(3-methylbutyl)-4-oxidanylidene-N-phenethyl-phthalazine-1-carboxamide

Systemtic Name: 3-(3-methylbutyl)-4-oxidanylidene-N-phenethyl-phthalazine-1-carboxamide Openeye Name: 3-isopentyl-4-oxo-N-phenethyl-phthalazine-1-carboxamide CAS Name: 3-(3-methylbutyl)-4-oxo-N-phenethyl-1-phthalazinecarboxamide IUPAC Name: 3-(3-methylbutyl)-4-oxo-N-phenethylphthalazine-1-carboxamide Traditional Name: 3-isoamyl-4-keto-N-phenethyl-phthalazine-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2/c1-16(2)13-15-25-22(27)19-11-7-6-10-18(19)20(24-25)21(26)23-14-12-17-8-4-3-5-9-17/h3-11,16H,12-15H2,1-2H3,(H,23,26)