3-butyl-N-[(2-chlorophenyl)methyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[(2-chlorophenyl)methyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[(2-chlorophenyl)methyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[(2-chlorophenyl)methyl]-N-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[(2-chlorophenyl)methyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-(2-chlorobenzyl)-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=CC=CC=C3Cl

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=CC=CC=C3Cl

InChI

InChI=1S/C21H22ClN3O2/c1-3-4-13-25-20(26)17-11-7-6-10-16(17)19(23-25)21(27)24(2)14-15-9-5-8-12-18(15)22/h5-12H,3-4,13-14H2,1-2H3