5-[4-[(E)-3-(5-bromanylfuran-2-yl)prop-2-enoyl]piperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[4-[(E)-3-(5-bromanylfuran-2-yl)prop-2-enoyl]piperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one Openeye Name: 5-[4-[(E)-3-(5-bromo-2-furyl)prop-2-enoyl]piperazin-1-yl]-4-chloro-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[(E)-3-(5-bromo-2-furanyl)-1-oxoprop-2-enyl]-1-piperazinyl]-4-chloro-2-phenyl-3-pyridazinone IUPAC Name: 5-[4-[(E)-3-(5-bromofuran-2-yl)prop-2-enoyl]piperazin-1-yl]-4-chloro-2-phenylpyridazin-3-one Traditional Name: 5-[4-[(E)-3-(5-bromo-2-furyl)acryloyl]piperazino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C21H18BrClN4O3 MolecularWeight: 489.74962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C=CC4=CC=C(O4)Br

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)/C=C/C4=CC=C(O4)Br

InChI

InChI=1S/C21H18BrClN4O3/c22-18-8-6-16(30-18)7-9-19(28)26-12-10-25(11-13-26)17-14-24-27(21(29)20(17)23)15-4-2-1-3-5-15/h1-9,14H,10-13H2/b9-7+