[1-(5-chloranyl-4-methyl-2-pyridin-2-ylsulfonyl-phenyl)sulfonyl-4-fluoranyl-piperidin-4-yl]methanamine

Systemtic Name: [1-(5-chloranyl-4-methyl-2-pyridin-2-ylsulfonyl-phenyl)sulfonyl-4-fluoranyl-piperidin-4-yl]methanamine Openeye Name: [1-[5-chloro-4-methyl-2-(2-pyridylsulfonyl)phenyl]sulfonyl-4-fluoro-4-piperidyl]methanamine CAS Name: [1-[5-chloro-4-methyl-2-(2-pyridinylsulfonyl)phenyl]sulfonyl-4-fluoro-4-piperidinyl]methanamine IUPAC Name: [1-(5-chloro-4-methyl-2-pyridin-2-ylsulfonylphenyl)sulfonyl-4-fluoropiperidin-4-yl]methanamine Traditional Name: [1-[5-chloro-4-methyl-2-(2-pyridylsulfonyl)phenyl]sulfonyl-4-fluoro-4-piperidyl]methylamine Formula: C18H21ClFN3O4S2 MolecularWeight: 461.958443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S(=O)(=O)N2CCC(CC2)(CN)F)S(=O)(=O)C3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S(=O)(=O)N2CCC(CC2)(CN)F)S(=O)(=O)C3=CC=CC=N3

InChI

InChI=1S/C18H21ClFN3O4S2/c1-13-10-15(28(24,25)17-4-2-3-7-22-17)16(11-14(13)19)29(26,27)23-8-5-18(20,12-21)6-9-23/h2-4,7,10-11H,5-6,8-9,12,21H2,1H3