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

Systemtic Name: 1-(1-adamantyl)-3-[2,4-bis(fluoranyl)phenyl]thiourea Openeye Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)thiourea CAS Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)thiourea IUPAC Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)thiourea Traditional Name: 1-(1-adamantyl)-3-(2,4-difluorophenyl)thiourea Formula: C17H20F2N2S MolecularWeight: 322.415906

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C17H20F2N2S/c18-13-1-2-15(14(19)6-13)20-16(22)21-17-7-10-3-11(8-17)5-12(4-10)9-17/h1-2,6,10-12H,3-5,7-9H2,(H2,20,21,22)