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

Systemtic Name: 4-oxidanylidene-3-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-phenyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]phthalazine-1-carboxamide Formula: C25H20N6O2 MolecularWeight: 436.4653

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=C(C=C4)CN5C=NC=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=C(C=C4)CN5C=NC=N5

InChI

InChI=1S/C25H20N6O2/c32-24(27-14-18-10-12-19(13-11-18)15-30-17-26-16-28-30)23-21-8-4-5-9-22(21)25(33)31(29-23)20-6-2-1-3-7-20/h1-13,16-17H,14-15H2,(H,27,32)