N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[[4-(1-imidazolylmethyl)phenyl]methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-[4-(imidazol-1-ylmethyl)benzyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

InChI

InChI=1S/C21H19N5O2/c27-20(11-19-17-3-1-2-4-18(17)21(28)25-24-19)23-12-15-5-7-16(8-6-15)13-26-10-9-22-14-26/h1-10,14H,11-13H2,(H,23,27)(H,25,28)