1-[4-(1-adamantylsulfamoyl)phenyl]-3-(3-ethanoylphenyl)thiourea

Systemtic Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(3-ethanoylphenyl)thiourea Openeye Name: 1-(3-acetylphenyl)-3-[4-(1-adamantylsulfamoyl)phenyl]thiourea CAS Name: 1-(3-acetylphenyl)-3-[4-(1-adamantylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[4-(1-adamantylsulfamoyl)phenyl]thiourea Traditional Name: 1-(3-acetylphenyl)-3-[4-(1-adamantylsulfamoyl)phenyl]thiourea Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H29N3O3S2/c1-16(29)20-3-2-4-22(12-20)27-24(32)26-21-5-7-23(8-6-21)33(30,31)28-25-13-17-9-18(14-25)11-19(10-17)15-25/h2-8,12,17-19,28H,9-11,13-15H2,1H3,(H2,26,27,32)