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

Systemtic Name: 3-methyl-4-oxidanylidene-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]phthalazine-1-carboxamide Formula: C20H18N6O2 MolecularWeight: 374.39592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C20H18N6O2/c1-13(14-7-9-15(10-8-14)26-12-21-11-22-26)23-19(27)18-16-5-3-4-6-17(16)20(28)25(2)24-18/h3-13H,1-2H3,(H,23,27)