N-[(2S)-1-(benzotriazol-1-yl)propan-2-yl]-2-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)ethanamide

Systemtic Name: N-[(2S)-1-(benzotriazol-1-yl)propan-2-yl]-2-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)ethanamide Openeye Name: N-[(1S)-2-(benzotriazol-1-yl)-1-methyl-ethyl]-2-(3-isopropyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[(2S)-1-(1-benzotriazolyl)propan-2-yl]-2-(4-oxo-3-propan-2-yl-1-phthalazinyl)acetamide IUPAC Name: N-[(2S)-1-(benzotriazol-1-yl)propan-2-yl]-2-(4-oxo-3-propan-2-ylphthalazin-1-yl)acetamide Traditional Name: N-[(1S)-2-(benzotriazol-1-yl)-1-methyl-ethyl]-2-(3-isopropyl-4-keto-phthalazin-1-yl)acetamide Formula: C22H24N6O2 MolecularWeight: 404.46496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NC(C)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C[C@@H](CN1C2=CC=CC=C2N=N1)NC(=O)CC3=NN(C(=O)C4=CC=CC=C43)C(C)C

InChI

InChI=1S/C22H24N6O2/c1-14(2)28-22(30)17-9-5-4-8-16(17)19(25-28)12-21(29)23-15(3)13-27-20-11-7-6-10-18(20)24-26-27/h4-11,14-15H,12-13H2,1-3H3,(H,23,29)/t15-/m0/s1