2-phenyl-1-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazin-1-yl]butan-1-one

Systemtic Name: 2-phenyl-1-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazin-1-yl]butan-1-one Openeye Name: 2-phenyl-1-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazin-1-yl]butan-1-one CAS Name: 2-phenyl-1-[4-[6-(2,4,5-trimethylphenyl)-3-pyridazinyl]-1-piperazinyl]-1-butanone IUPAC Name: 2-phenyl-1-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazin-1-yl]butan-1-one Traditional Name: 2-phenyl-1-[4-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]piperazino]butan-1-one Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC(=C(C=C4C)C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC(=C(C=C4C)C)C

InChI

InChI=1S/C27H32N4O/c1-5-23(22-9-7-6-8-10-22)27(32)31-15-13-30(14-16-31)26-12-11-25(28-29-26)24-18-20(3)19(2)17-21(24)4/h6-12,17-18,23H,5,13-16H2,1-4H3