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

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

CC1=CC(=C(C=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)CCCC4=CC=CC=C4)C)C

InChI

InChI=1S/C27H32N4O/c1-20-18-22(3)24(19-21(20)2)25-12-13-26(29-28-25)30-14-16-31(17-15-30)27(32)11-7-10-23-8-5-4-6-9-23/h4-6,8-9,12-13,18-19H,7,10-11,14-17H2,1-3H3