2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-methyl-amino]-N-(2-methyl-5-piperidinosulfonyl-phenyl)acetamide Formula: C22H27ClFN3O3S MolecularWeight: 467.984483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN(C)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN(C)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H27ClFN3O3S/c1-16-9-10-17(31(29,30)27-11-4-3-5-12-27)13-21(16)25-22(28)15-26(2)14-18-19(23)7-6-8-20(18)24/h6-10,13H,3-5,11-12,14-15H2,1-2H3,(H,25,28)