N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[3-chloro-4-[diethylamino(oxo)methyl]phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)C(=O)N(CC)CC)Cl

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)C(=O)N(CC)CC)Cl

InChI

InChI=1S/C23H25ClN4O3/c1-4-13-28-23(31)17-10-8-7-9-16(17)20(26-28)21(29)25-15-11-12-18(19(24)14-15)22(30)27(5-2)6-3/h7-12,14H,4-6,13H2,1-3H3,(H,25,29)