N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-hexyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-[(2-chlorophenyl)methyl]-3-pyrazolyl]-3-hexyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-hexyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(2-chlorobenzyl)pyrazol-3-yl]-3-hexyl-4-keto-phthalazine-1-carboxamide Formula: C25H26ClN5O2 MolecularWeight: 463.95924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=CC=C4Cl

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=CC=C4Cl

InChI

InChI=1S/C25H26ClN5O2/c1-2-3-4-9-16-30-25(33)20-12-7-6-11-19(20)23(29-30)24(32)28-22-14-15-27-31(22)17-18-10-5-8-13-21(18)26/h5-8,10-15H,2-4,9,16-17H2,1H3,(H,28,32)