1-[2-(1-adamantyl)ethanoylamino]-3-(3-chloranyl-4-fluoranyl-phenyl)thiourea

Systemtic Name: 1-[2-(1-adamantyl)ethanoylamino]-3-(3-chloranyl-4-fluoranyl-phenyl)thiourea Openeye Name: 1-[[2-(1-adamantyl)acetyl]amino]-3-(3-chloro-4-fluoro-phenyl)thiourea CAS Name: 1-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-(3-chloro-4-fluorophenyl)thiourea IUPAC Name: 1-[[2-(1-adamantyl)acetyl]amino]-3-(3-chloro-4-fluorophenyl)thiourea Traditional Name: 1-[[2-(1-adamantyl)acetyl]amino]-3-(3-chloro-4-fluoro-phenyl)thiourea Formula: C19H23ClFN3OS MolecularWeight: 395.921823

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NNC(=S)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NNC(=S)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C19H23ClFN3OS/c20-15-6-14(1-2-16(15)21)22-18(26)24-23-17(25)10-19-7-11-3-12(8-19)5-13(4-11)9-19/h1-2,6,11-13H,3-5,7-10H2,(H,23,25)(H2,22,24,26)