1-[5-(cyclopentylamino)-1-(6-methylsulfonylpyridazin-3-yl)-3-(trifluoromethyl)pyrazol-4-yl]ethanone

Systemtic Name: 1-[5-(cyclopentylamino)-1-(6-methylsulfonylpyridazin-3-yl)-3-(trifluoromethyl)pyrazol-4-yl]ethanone Openeye Name: 1-[5-(cyclopentylamino)-1-(6-methylsulfonylpyridazin-3-yl)-3-(trifluoromethyl)pyrazol-4-yl]ethanone CAS Name: 1-[5-(cyclopentylamino)-1-(6-methylsulfonyl-3-pyridazinyl)-3-(trifluoromethyl)-4-pyrazolyl]ethanone IUPAC Name: 1-[5-(cyclopentylamino)-1-(6-methylsulfonylpyridazin-3-yl)-3-(trifluoromethyl)pyrazol-4-yl]ethanone Traditional Name: 1-[5-(cyclopentylamino)-1-(6-mesylpyridazin-3-yl)-3-(trifluoromethyl)pyrazol-4-yl]ethanone Formula: C16H18F3N5O3S MolecularWeight: 417.40603

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(N=C1C(F)(F)F)C2=NN=C(C=C2)S(=O)(=O)C)NC3CCCC3

Isomeric SMILES

CC(=O)C1=C(N(N=C1C(F)(F)F)C2=NN=C(C=C2)S(=O)(=O)C)NC3CCCC3

InChI

InChI=1S/C16H18F3N5O3S/c1-9(25)13-14(16(17,18)19)23-24(15(13)20-10-5-3-4-6-10)11-7-8-12(22-21-11)28(2,26)27/h7-8,10,20H,3-6H2,1-2H3