N-(4-methylpyrimidin-2-yl)-4-(3-morpholin-4-ylpropylsulfonylamino)benzenesulfonamide

Systemtic Name: N-(4-methylpyrimidin-2-yl)-4-(3-morpholin-4-ylpropylsulfonylamino)benzenesulfonamide Openeye Name: N-(4-methylpyrimidin-2-yl)-4-(3-morpholinopropylsulfonylamino)benzenesulfonamide CAS Name: N-(4-methyl-2-pyrimidinyl)-4-[3-(4-morpholinyl)propylsulfonylamino]benzenesulfonamide IUPAC Name: N-(4-methylpyrimidin-2-yl)-4-(3-morpholin-4-ylpropylsulfonylamino)benzenesulfonamide Traditional Name: N-(4-methylpyrimidin-2-yl)-4-(3-morpholinopropylsulfonylamino)benzenesulfonamide Formula: C18H25N5O5S2 MolecularWeight: 455.5516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)CCCN3CCOCC3

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)CCCN3CCOCC3

InChI

InChI=1S/C18H25N5O5S2/c1-15-7-8-19-18(20-15)22-30(26,27)17-5-3-16(4-6-17)21-29(24,25)14-2-9-23-10-12-28-13-11-23/h3-8,21H,2,9-14H2,1H3,(H,19,20,22)