5-oxidanylidene-N-[3-[[(4-oxidanylidene-3H-phthalazin-1-yl)amino]methyl]phenyl]-5-thiophen-2-yl-pentanamide

Systemtic Name: 5-oxidanylidene-N-[3-[[(4-oxidanylidene-3H-phthalazin-1-yl)amino]methyl]phenyl]-5-thiophen-2-yl-pentanamide Openeye Name: 5-oxo-N-[3-[[(4-oxo-3H-phthalazin-1-yl)amino]methyl]phenyl]-5-(2-thienyl)pentanamide CAS Name: 5-oxo-N-[3-[[(4-oxo-3H-phthalazin-1-yl)amino]methyl]phenyl]-5-thiophen-2-ylpentanamide IUPAC Name: 5-oxo-N-[3-[[(4-oxo-3H-phthalazin-1-yl)amino]methyl]phenyl]-5-thiophen-2-ylpentanamide Traditional Name: 5-keto-N-[3-[[(4-keto-3H-phthalazin-1-yl)amino]methyl]phenyl]-5-(2-thienyl)valeramide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C2NCC3=CC(=CC=C3)NC(=O)CCCC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C2NCC3=CC(=CC=C3)NC(=O)CCCC(=O)C4=CC=CS4

InChI

InChI=1S/C24H22N4O3S/c29-20(21-11-5-13-32-21)10-4-12-22(30)26-17-7-3-6-16(14-17)15-25-23-18-8-1-2-9-19(18)24(31)28-27-23/h1-3,5-9,11,13-14H,4,10,12,15H2,(H,25,27)(H,26,30)(H,28,31)