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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[2-(2-oxoazepan-1-yl)acetyl]amino]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[[2-(2-oxoazepan-1-yl)acetyl]amino]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[2-(2-ketoazepan-1-yl)acetyl]amino]thiourea Formula: C15H18ClFN4O2S MolecularWeight: 372.845423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NNC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NNC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H18ClFN4O2S/c16-11-8-10(5-6-12(11)17)18-15(24)20-19-13(22)9-21-7-3-1-2-4-14(21)23/h5-6,8H,1-4,7,9H2,(H,19,22)(H2,18,20,24)