2-[2-(4-bromanylphenoxy)ethyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[2-(4-bromanylphenoxy)ethyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[2-(4-bromophenoxy)ethyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[2-(4-bromophenoxy)ethyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[2-(4-bromophenoxy)ethyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-[2-(4-bromophenoxy)ethyl]-4-(2-thienyl)phthalazin-1-one Formula: C20H15BrN2O2S MolecularWeight: 427.3143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CCOC3=CC=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CCOC3=CC=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C20H15BrN2O2S/c21-14-7-9-15(10-8-14)25-12-11-23-20(24)17-5-2-1-4-16(17)19(22-23)18-6-3-13-26-18/h1-10,13H,11-12H2