N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-keto-phthalazine-1-carboxamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC(=N4)C(C)(C)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC(=N4)C(C)(C)C

InChI

InChI=1S/C25H28N4O3/c1-5-6-9-14-29-23(31)18-11-8-7-10-17(18)21(28-29)22(30)26-16-12-13-20-19(15-16)27-24(32-20)25(2,3)4/h7-8,10-13,15H,5-6,9,14H2,1-4H3,(H,26,30)