4-oxidanylidene-N-[2-(phenethylcarbamoyl)phenyl]-3-propyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[2-(phenethylcarbamoyl)phenyl]-3-propyl-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[2-(phenethylcarbamoyl)phenyl]-3-propyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[2-[oxo-(phenethylamino)methyl]phenyl]-3-propyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-[2-(phenethylcarbamoyl)phenyl]-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-(phenethylcarbamoyl)phenyl]-3-propyl-phthalazine-1-carboxamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3/c1-2-18-31-27(34)21-13-7-6-12-20(21)24(30-31)26(33)29-23-15-9-8-14-22(23)25(32)28-17-16-19-10-4-3-5-11-19/h3-15H,2,16-18H2,1H3,(H,28,32)(H,29,33)