1-(1-adamantylcarbonylamino)-3-(3-chlorophenyl)thiourea

Systemtic Name: 1-(1-adamantylcarbonylamino)-3-(3-chlorophenyl)thiourea Openeye Name: 1-(adamantane-1-carbonylamino)-3-(3-chlorophenyl)thiourea CAS Name: 1-[[1-adamantyl(oxo)methyl]amino]-3-(3-chlorophenyl)thiourea IUPAC Name: 1-(adamantane-1-carbonylamino)-3-(3-chlorophenyl)thiourea Traditional Name: 1-(adamantane-1-carbonylamino)-3-(3-chlorophenyl)thiourea Formula: C18H22ClN3OS MolecularWeight: 363.90478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=S)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=S)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H22ClN3OS/c19-14-2-1-3-15(7-14)20-17(24)22-21-16(23)18-8-11-4-12(9-18)6-13(5-11)10-18/h1-3,7,11-13H,4-6,8-10H2,(H,21,23)(H2,20,22,24)