N-[(1R)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(1R)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(1R)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(1R)-1-(1,3-benzoxazol-2-yl)-3-methylbutyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(1R)-1-(1,3-benzoxazol-2-yl)-3-methylbutyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(1R)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H22N4O3 MolecularWeight: 390.43508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC2=CC=CC=C2O1)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC(C)C[C@H](C1=NC2=CC=CC=C2O1)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C22H22N4O3/c1-13(2)12-17(21-24-16-10-6-7-11-18(16)29-21)23-20(27)19-14-8-4-5-9-15(14)22(28)26(3)25-19/h4-11,13,17H,12H2,1-3H3,(H,23,27)/t17-/m1/s1