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

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(cyclopentylamino)-1-(5-methylsulfonylpyridin-2-yl)pyrazole-4-carbaldehyde Openeye Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-methylsulfonyl-2-pyridyl)pyrazole-4-carbaldehyde CAS Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-methylsulfonyl-2-pyridinyl)-4-pyrazolecarboxaldehyde IUPAC Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-methylsulfonylpyridin-2-yl)pyrazole-4-carbaldehyde Traditional Name: 5-(cyclopentylamino)-3-(difluoromethyl)-1-(5-mesyl-2-pyridyl)pyrazole-4-carbaldehyde Formula: C16H18F2N4O3S MolecularWeight: 384.400926

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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=O)NC3CCCC3

Isomeric SMILES

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

InChI

InChI=1S/C16H18F2N4O3S/c1-26(24,25)11-6-7-13(19-8-11)22-16(20-10-4-2-3-5-10)12(9-23)14(21-22)15(17)18/h6-10,15,20H,2-5H2,1H3