4-oxidanylidene-N-[(2S)-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(2S)-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[(1S)-1-[[6-oxo-3-(2-thienyl)pyridazin-1-yl]methyl]propyl]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[(2S)-1-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butan-2-yl]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[(2S)-1-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butan-2-yl]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(1S)-1-[[6-keto-3-(2-thienyl)pyridazin-1-yl]methyl]propyl]-3H-phthalazine-1-carboxamide Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=O)C=CC(=N1)C2=CC=CS2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC[C@@H](CN1C(=O)C=CC(=N1)C2=CC=CS2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H19N5O3S/c1-2-13(12-26-18(27)10-9-16(25-26)17-8-5-11-30-17)22-21(29)19-14-6-3-4-7-15(14)20(28)24-23-19/h3-11,13H,2,12H2,1H3,(H,22,29)(H,24,28)/t13-/m0/s1