1-[1-(1-adamantyl)propyl]-3-(3-ethanoylphenyl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)propyl]-3-(3-ethanoylphenyl)thiourea Openeye Name: 1-(3-acetylphenyl)-3-[1-(1-adamantyl)propyl]thiourea CAS Name: 1-(3-acetylphenyl)-3-[1-(1-adamantyl)propyl]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[1-(1-adamantyl)propyl]thiourea Traditional Name: 1-(3-acetylphenyl)-3-[1-(1-adamantyl)propyl]thiourea Formula: C22H30N2OS MolecularWeight: 370.5514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2OS/c1-3-20(22-11-15-7-16(12-22)9-17(8-15)13-22)24-21(26)23-19-6-4-5-18(10-19)14(2)25/h4-6,10,15-17,20H,3,7-9,11-13H2,1-2H3,(H2,23,24,26)