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

Systemtic Name: N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-(thiophen-2-ylmethylamino)pentanamide Openeye Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(2-thienylmethylamino)pentanamide CAS Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(thiophen-2-ylmethylamino)pentanamide IUPAC Name: N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(thiophen-2-ylmethylamino)pentanamide Traditional Name: N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]-5-(2-thenylamino)valeramide Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)NC(=O)CCCCNCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)NC(=O)CCCCNCC4=CC=CS4

InChI

InChI=1S/C24H24N4O2S/c29-22(12-3-4-13-25-16-19-9-6-14-31-19)26-18-8-5-7-17(15-18)23-20-10-1-2-11-21(20)24(30)28-27-23/h1-2,5-11,14-15,25H,3-4,12-13,16H2,(H,26,29)(H,28,30)