1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C13H18ClFN3OS+ MolecularWeight: 318.817923

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H17ClFN3OS/c14-11-9-10(1-2-12(11)15)17-13(20)16-3-4-18-5-7-19-8-6-18/h1-2,9H,3-8H2,(H2,16,17,20)/p+1