1-[4-(1-adamantylsulfamoyl)phenyl]-3-(1,3-benzodioxol-5-yl)thiourea

Systemtic Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(1,3-benzodioxol-5-yl)thiourea Openeye Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(1,3-benzodioxol-5-yl)thiourea CAS Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(1,3-benzodioxol-5-yl)thiourea IUPAC Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(1,3-benzodioxol-5-yl)thiourea Traditional Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(1,3-benzodioxol-5-yl)thiourea Formula: C24H27N3O4S2 MolecularWeight: 485.61888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC=C(C=C4)NC(=S)NC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC=C(C=C4)NC(=S)NC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C24H27N3O4S2/c28-33(29,27-24-11-15-7-16(12-24)9-17(8-15)13-24)20-4-1-18(2-5-20)25-23(32)26-19-3-6-21-22(10-19)31-14-30-21/h1-6,10,15-17,27H,7-9,11-14H2,(H2,25,26,32)