4-oxidanylidene-3-(phenylmethyl)-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[4-(tetrazol-1-yl)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[4-(1-tetrazolyl)phenyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[4-(tetrazol-1-yl)phenyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[4-(tetrazol-1-yl)phenyl]phthalazine-1-carboxamide Formula: C23H17N7O2 MolecularWeight: 423.42678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=C(C=C4)N5C=NN=N5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=C(C=C4)N5C=NN=N5

InChI

InChI=1S/C23H17N7O2/c31-22(25-17-10-12-18(13-11-17)30-15-24-27-28-30)21-19-8-4-5-9-20(19)23(32)29(26-21)14-16-6-2-1-3-7-16/h1-13,15H,14H2,(H,25,31)