1-(2-adamantyl)-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-(2-adamantyl)-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-(2-adamantyl)-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-(2-adamantyl)-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-(2-adamantyl)-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-(2-adamantyl)-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C18H23FN2S MolecularWeight: 318.452023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4)F

InChI

InChI=1S/C18H23FN2S/c1-10-2-3-15(9-16(10)19)20-18(22)21-17-13-5-11-4-12(7-13)8-14(17)6-11/h2-3,9,11-14,17H,4-8H2,1H3,(H2,20,21,22)