1-[3-[(dimethylsulfamoylmethylamino)methyl]-5-fluoranyl-phenyl]-3-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[3-[(dimethylsulfamoylmethylamino)methyl]-5-fluoranyl-phenyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[3-[(dimethylsulfamoylmethylamino)methyl]-5-fluoro-phenyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[3-[(dimethylsulfamoylmethylamino)methyl]-5-fluorophenyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[3-[(dimethylsulfamoylmethylamino)methyl]-5-fluorophenyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[3-[(dimethylsulfamoylmethylamino)methyl]-5-fluoro-phenyl]-3-(6-methyl-3-pyridyl)urea Formula: C17H22FN5O3S MolecularWeight: 395.451683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)NC(=O)NC2=CC(=CC(=C2)CNCS(=O)(=O)N(C)C)F

Isomeric SMILES

CC1=NC=C(C=C1)NC(=O)NC2=CC(=CC(=C2)CNCS(=O)(=O)N(C)C)F

InChI

InChI=1S/C17H22FN5O3S/c1-12-4-5-15(10-20-12)21-17(24)22-16-7-13(6-14(18)8-16)9-19-11-27(25,26)23(2)3/h4-8,10,19H,9,11H2,1-3H3,(H2,21,22,24)