3-cyclopentyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylethanoyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylethanoyl]piperazin-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylacetyl]piperazin-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[2-methyl-4-[1-oxo-2-[(6-phenyl-3-pyridazinyl)thio]ethyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[2-methyl-4-[2-(6-phenylpyridazin-3-yl)sulfanylacetyl]piperazin-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[2-methyl-4-[2-[(6-phenylpyridazin-3-yl)thio]acetyl]piperazino]propan-1-one Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CCC2CCCC2)C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)CCC2CCCC2)C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4O2S/c1-19-17-28(15-16-29(19)24(30)14-11-20-7-5-6-8-20)25(31)18-32-23-13-12-22(26-27-23)21-9-3-2-4-10-21/h2-4,9-10,12-13,19-20H,5-8,11,14-18H2,1H3