2-(3-oxidanylidene-1H-isoindol-2-yl)-N-[(2S)-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]ethanamide

Systemtic Name: 2-(3-oxidanylidene-1H-isoindol-2-yl)-N-[(2S)-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]ethanamide Openeye Name: 2-(1-oxoisoindolin-2-yl)-N-[(1S)-1-[[6-oxo-3-(2-thienyl)pyridazin-1-yl]methyl]propyl]acetamide CAS Name: 2-(3-oxo-1H-isoindol-2-yl)-N-[(2S)-1-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butan-2-yl]acetamide IUPAC Name: 2-(3-oxo-1H-isoindol-2-yl)-N-[(2S)-1-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butan-2-yl]acetamide Traditional Name: 2-(1-ketoisoindolin-2-yl)-N-[(1S)-1-[[6-keto-3-(2-thienyl)pyridazin-1-yl]methyl]propyl]acetamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=O)C=CC(=N1)C2=CC=CS2)NC(=O)CN3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC[C@@H](CN1C(=O)C=CC(=N1)C2=CC=CS2)NC(=O)CN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H22N4O3S/c1-2-16(13-26-21(28)10-9-18(24-26)19-8-5-11-30-19)23-20(27)14-25-12-15-6-3-4-7-17(15)22(25)29/h3-11,16H,2,12-14H2,1H3,(H,23,27)/t16-/m0/s1