6-bromanyl-3-[4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6-bromanyl-3-[4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6-bromo-3-[4-[6-(p-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one CAS Name: 6-bromo-3-[[4-[6-(4-methylphenyl)-3-pyridazinyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-[6-(4-methylphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 6-bromo-3-[4-[6-(p-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]coumarin Formula: C25H21BrN4O3 MolecularWeight: 505.36324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=CC(=C5)Br)OC4=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=CC(=C5)Br)OC4=O

InChI

InChI=1S/C25H21BrN4O3/c1-16-2-4-17(5-3-16)21-7-9-23(28-27-21)29-10-12-30(13-11-29)24(31)20-15-18-14-19(26)6-8-22(18)33-25(20)32/h2-9,14-15H,10-13H2,1H3