1-(1-adamantylmethyl)-3-(4-ethanoylphenyl)thiourea

Systemtic Name: 1-(1-adamantylmethyl)-3-(4-ethanoylphenyl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-(1-adamantylmethyl)thiourea CAS Name: 1-(4-acetylphenyl)-3-(1-adamantylmethyl)thiourea IUPAC Name: 1-(4-acetylphenyl)-3-(1-adamantylmethyl)thiourea Traditional Name: 1-(4-acetylphenyl)-3-(1-adamantylmethyl)thiourea Formula: C20H26N2OS MolecularWeight: 342.49824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26N2OS/c1-13(23)17-2-4-18(5-3-17)22-19(24)21-12-20-9-14-6-15(10-20)8-16(7-14)11-20/h2-5,14-16H,6-12H2,1H3,(H2,21,22,24)