1-[1-(1-adamantyl)butyl]-3-[4-(diethylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-[1-(1-adamantyl)butyl]-3-[4-(diethylsulfamoyl)phenyl]thiourea Openeye Name: 1-[1-(1-adamantyl)butyl]-3-[4-(diethylsulfamoyl)phenyl]thiourea CAS Name: 1-[1-(1-adamantyl)butyl]-3-[4-(diethylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[1-(1-adamantyl)butyl]-3-[4-(diethylsulfamoyl)phenyl]thiourea Traditional Name: 1-[1-(1-adamantyl)butyl]-3-[4-(diethylsulfamoyl)phenyl]thiourea Formula: C25H39N3O2S2 MolecularWeight: 477.72606

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C25H39N3O2S2/c1-4-7-23(25-15-18-12-19(16-25)14-20(13-18)17-25)27-24(31)26-21-8-10-22(11-9-21)32(29,30)28(5-2)6-3/h8-11,18-20,23H,4-7,12-17H2,1-3H3,(H2,26,27,31)