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

Systemtic Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea Formula: C23H26N4O4S2 MolecularWeight: 486.60694

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC=C(C=C4)NC(=S)NC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC=C(C=C4)NC(=S)NC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4S2/c28-27(29)20-3-1-2-19(11-20)25-22(32)24-18-4-6-21(7-5-18)33(30,31)26-23-12-15-8-16(13-23)10-17(9-15)14-23/h1-7,11,15-17,26H,8-10,12-14H2,(H2,24,25,32)