2-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-[2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-(2-thienyl)phthalazin-1-one Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

InChI

InChI=1S/C21H19N3O2S/c1-13-11-17(14(2)23(13)3)18(25)12-24-21(26)16-8-5-4-7-15(16)20(22-24)19-9-6-10-27-19/h4-11H,12H2,1-3H3