6-bromanyl-3-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6-bromanyl-3-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6-bromo-3-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one CAS Name: 6-bromo-3-[oxo-[4-[6-(2,4,5-trimethylphenyl)-3-pyridazinyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 6-bromo-3-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazine-1-carbonyl]coumarin Formula: C27H25BrN4O3 MolecularWeight: 533.4164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=CC(=C5)Br)OC4=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=CC(=C5)Br)OC4=O)C)C

InChI

InChI=1S/C27H25BrN4O3/c1-16-12-18(3)21(13-17(16)2)23-5-7-25(30-29-23)31-8-10-32(11-9-31)26(33)22-15-19-14-20(28)4-6-24(19)35-27(22)34/h4-7,12-15H,8-11H2,1-3H3