1-[1-(1-adamantyl)propyl]-3-(3-chloranyl-4-fluoranyl-phenyl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)propyl]-3-(3-chloranyl-4-fluoranyl-phenyl)thiourea Openeye Name: 1-[1-(1-adamantyl)propyl]-3-(3-chloro-4-fluoro-phenyl)thiourea CAS Name: 1-[1-(1-adamantyl)propyl]-3-(3-chloro-4-fluorophenyl)thiourea IUPAC Name: 1-[1-(1-adamantyl)propyl]-3-(3-chloro-4-fluorophenyl)thiourea Traditional Name: 1-[1-(1-adamantyl)propyl]-3-(3-chloro-4-fluoro-phenyl)thiourea Formula: C20H26ClFN2S MolecularWeight: 380.950243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26ClFN2S/c1-2-18(20-9-12-5-13(10-20)7-14(6-12)11-20)24-19(25)23-15-3-4-17(22)16(21)8-15/h3-4,8,12-14,18H,2,5-7,9-11H2,1H3,(H2,23,24,25)