N-[1-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylpiperidin-4-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[1-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylpiperidin-4-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[1-(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)-4-piperidyl]-4-fluoro-benzenesulfonamide CAS Name: N-[1-[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]-4-piperidinyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[1-(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)piperidin-4-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[1-[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]-4-piperidyl]-4-fluoro-benzenesulfonamide Formula: C17H18ClFN4O3S2 MolecularWeight: 444.931223

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C17H18ClFN4O3S2/c1-27-17-20-10-14(18)15(21-17)16(24)23-8-6-12(7-9-23)22-28(25,26)13-4-2-11(19)3-5-13/h2-5,10,12,22H,6-9H2,1H3