2-(furan-2-yl)-5-[4-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(furan-2-yl)-5-[4-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(2-furyl)-5-[4-(4-oxo-3-pentyl-phthalazine-1-carbonyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-(2-furanyl)-5-[4-[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-(furan-2-yl)-5-[4-(4-oxo-3-pentylphthalazine-1-carbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(3-amyl-4-keto-phthalazine-1-carbonyl)piperazino]-2-(2-furyl)oxazole-4-carbonitrile Formula: C26H26N6O4 MolecularWeight: 486.52244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=C(N=C(O4)C5=CC=CO5)C#N

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=C(N=C(O4)C5=CC=CO5)C#N

InChI

InChI=1S/C26H26N6O4/c1-2-3-6-11-32-24(33)19-9-5-4-8-18(19)22(29-32)25(34)30-12-14-31(15-13-30)26-20(17-27)28-23(36-26)21-10-7-16-35-21/h4-5,7-10,16H,2-3,6,11-15H2,1H3