3,5,5-trimethyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylethanoyl]piperazin-1-yl]hexan-1-one

Systemtic Name: 3,5,5-trimethyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylethanoyl]piperazin-1-yl]hexan-1-one Openeye Name: 3,5,5-trimethyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylacetyl]piperazin-1-yl]hexan-1-one CAS Name: 3,5,5-trimethyl-1-[2-methyl-4-[1-oxo-2-[(6-phenyl-3-pyridazinyl)thio]ethyl]-1-piperazinyl]-1-hexanone IUPAC Name: 3,5,5-trimethyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylacetyl]piperazin-1-yl]hexan-1-one Traditional Name: 3,5,5-trimethyl-1-[2-methyl-4-[2-[(6-phenylpyridazin-3-yl)thio]acetyl]piperazino]hexan-1-one Formula: C26H36N4O2S MolecularWeight: 468.65464

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC(C)CC(C)(C)C)C(=O)CSC2=NN=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1CN(CCN1C(=O)CC(C)CC(C)(C)C)C(=O)CSC2=NN=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H36N4O2S/c1-19(16-26(3,4)5)15-24(31)30-14-13-29(17-20(30)2)25(32)18-33-23-12-11-22(27-28-23)21-9-7-6-8-10-21/h6-12,19-20H,13-18H2,1-5H3