1-(1-adamantylcarbonylamino)-3-(2,4-dichlorophenyl)thiourea

Systemtic Name: 1-(1-adamantylcarbonylamino)-3-(2,4-dichlorophenyl)thiourea Openeye Name: 1-(adamantane-1-carbonylamino)-3-(2,4-dichlorophenyl)thiourea CAS Name: 1-[[1-adamantyl(oxo)methyl]amino]-3-(2,4-dichlorophenyl)thiourea IUPAC Name: 1-(adamantane-1-carbonylamino)-3-(2,4-dichlorophenyl)thiourea Traditional Name: 1-(adamantane-1-carbonylamino)-3-(2,4-dichlorophenyl)thiourea Formula: C18H21Cl2N3OS MolecularWeight: 398.34984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21Cl2N3OS/c19-13-1-2-15(14(20)6-13)21-17(25)23-22-16(24)18-7-10-3-11(8-18)5-12(4-10)9-18/h1-2,6,10-12H,3-5,7-9H2,(H,22,24)(H2,21,23,25)