1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]thiourea Formula: C19H22ClFN3OS+ MolecularWeight: 394.913883

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1COCC[NH+]1C[C@@H](C2=CC=CC=C2)NC(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H21ClFN3OS/c20-16-12-15(6-7-17(16)21)22-19(26)23-18(14-4-2-1-3-5-14)13-24-8-10-25-11-9-24/h1-7,12,18H,8-11,13H2,(H2,22,23,26)/p+1/t18-/m0/s1