3-[bis(fluoranyl)methyl]-5-(cyclopentylamino)-1-(5-methylsulfonylpyridin-2-yl)pyrazole-4-carbonitrile

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(cyclopentylamino)-1-(5-methylsulfonylpyridin-2-yl)pyrazole-4-carbonitrile Openeye Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-methylsulfonyl-2-pyridyl)pyrazole-4-carbonitrile CAS Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-methylsulfonyl-2-pyridinyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-methylsulfonylpyridin-2-yl)pyrazole-4-carbonitrile Traditional Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-mesyl-2-pyridyl)pyrazole-4-carbonitrile Formula: C16H17F2N5O2S MolecularWeight: 381.400286

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)F)C#N)NC3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)F)C#N)NC3CCCC3

InChI

InChI=1S/C16H17F2N5O2S/c1-26(24,25)11-6-7-13(20-9-11)23-16(21-10-4-2-3-5-10)12(8-19)14(22-23)15(17)18/h6-7,9-10,15,21H,2-5H2,1H3