1-(1-adamantyl)-3-[2,4-bis(fluoranyl)phenyl]-1-methyl-thiourea

Systemtic Name: 1-(1-adamantyl)-3-[2,4-bis(fluoranyl)phenyl]-1-methyl-thiourea Openeye Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)-1-methyl-thiourea CAS Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)-1-methylthiourea IUPAC Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)-1-methylthiourea Traditional Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)-1-methyl-thiourea Formula: C18H22F2N2S MolecularWeight: 336.442486

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NC1=C(C=C(C=C1)F)F)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C(=S)NC1=C(C=C(C=C1)F)F)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H22F2N2S/c1-22(17(23)21-16-3-2-14(19)7-15(16)20)18-8-11-4-12(9-18)6-13(5-11)10-18/h2-3,7,11-13H,4-6,8-10H2,1H3,(H,21,23)