1-[4-(azepan-1-yl)-6-fluoranyl-pyrimidin-2-yl]-3-[2-(dimethylsulfamoyl)phenyl]sulfonyl-urea

Systemtic Name: 1-[4-(azepan-1-yl)-6-fluoranyl-pyrimidin-2-yl]-3-[2-(dimethylsulfamoyl)phenyl]sulfonyl-urea Openeye Name: 1-[4-(azepan-1-yl)-6-fluoro-pyrimidin-2-yl]-3-[2-(dimethylsulfamoyl)phenyl]sulfonyl-urea CAS Name: 1-[4-(1-azepanyl)-6-fluoro-2-pyrimidinyl]-3-[2-(dimethylsulfamoyl)phenyl]sulfonylurea IUPAC Name: 1-[4-(azepan-1-yl)-6-fluoropyrimidin-2-yl]-3-[2-(dimethylsulfamoyl)phenyl]sulfonylurea Traditional Name: 1-[4-(azepan-1-yl)-6-fluoro-pyrimidin-2-yl]-3-[2-(dimethylsulfamoyl)phenyl]sulfonyl-urea Formula: C19H25FN6O5S2 MolecularWeight: 500.567403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)F)N3CCCCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)F)N3CCCCCC3

InChI

InChI=1S/C19H25FN6O5S2/c1-25(2)33(30,31)15-10-6-5-9-14(15)32(28,29)24-19(27)23-18-21-16(20)13-17(22-18)26-11-7-3-4-8-12-26/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3,(H2,21,22,23,24,27)