N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide

Systemtic Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide Openeye Name: 2-(1-oxophthalazin-2-yl)-N-[4-(4-sec-butylphenyl)thiazol-2-yl]acetamide CAS Name: N-[4-(4-butan-2-ylphenyl)-2-thiazolyl]-2-(1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2-(1-oxophthalazin-2-yl)acetamide Traditional Name: 2-(1-ketophthalazin-2-yl)-N-[4-(4-sec-butylphenyl)thiazol-2-yl]acetamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C23H22N4O2S/c1-3-15(2)16-8-10-17(11-9-16)20-14-30-23(25-20)26-21(28)13-27-22(29)19-7-5-4-6-18(19)12-24-27/h4-12,14-15H,3,13H2,1-2H3,(H,25,26,28)