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

Systemtic Name: N-[3-chloranyl-2-(dimethylamino)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[3-chloro-2-(dimethylamino)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[3-chloro-2-(dimethylamino)phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[3-chloro-2-(dimethylamino)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[3-chloro-2-(dimethylamino)phenyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O2/c1-4-12-25-20(27)14-9-6-5-8-13(14)17(23-25)19(26)22-16-11-7-10-15(21)18(16)24(2)3/h5-11H,4,12H2,1-3H3,(H,22,26)