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

Systemtic Name: 4-oxidanylidene-3-phenyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-phenyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[4-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]phenyl]-3-phenyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-phenyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-phenyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]phthalazine-1-carboxamide Formula: C26H21N7O3 MolecularWeight: 479.49004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)N5C=NC=N5

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)N5C=NC=N5

InChI

InChI=1S/C26H21N7O3/c1-17(32-16-27-15-28-32)24(34)29-18-11-13-19(14-12-18)30-25(35)23-21-9-5-6-10-22(21)26(36)33(31-23)20-7-3-2-4-8-20/h2-17H,1H3,(H,29,34)(H,30,35)