1-(3-chloranyl-4-fluoranyl-phenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[3-(1-piperidin-1-iumyl)propyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Formula: C15H22ClFN3S+ MolecularWeight: 330.871683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H21ClFN3S/c16-13-11-12(5-6-14(13)17)19-15(21)18-7-4-10-20-8-2-1-3-9-20/h5-6,11H,1-4,7-10H2,(H2,18,19,21)/p+1