1-(1-adamantylmethyl)-3-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]urea

Systemtic Name: 1-(1-adamantylmethyl)-3-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]urea Openeye Name: 1-(1-adamantylmethyl)-3-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]urea CAS Name: 1-(1-adamantylmethyl)-3-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]urea IUPAC Name: 1-(1-adamantylmethyl)-3-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]urea Traditional Name: 1-(1-adamantylmethyl)-3-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]urea Formula: C23H29N5O3S MolecularWeight: 455.57306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N5O3S/c1-15-6-7-24-21(26-15)28-32(30,31)20-4-2-19(3-5-20)27-22(29)25-14-23-11-16-8-17(12-23)10-18(9-16)13-23/h2-7,16-18H,8-14H2,1H3,(H,24,26,28)(H2,25,27,29)