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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[(2R)-2-(4-methyl-1-piperazin-4-iumyl)propyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)propyl]thiourea Formula: C15H23ClFN4S+ MolecularWeight: 345.886323

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=S)NC1=CC(=C(C=C1)F)Cl)N2CC[NH+](CC2)C

Isomeric SMILES

C[C@H](CNC(=S)NC1=CC(=C(C=C1)F)Cl)N2CC[NH+](CC2)C

InChI

InChI=1S/C15H22ClFN4S/c1-11(21-7-5-20(2)6-8-21)10-18-15(22)19-12-3-4-14(17)13(16)9-12/h3-4,9,11H,5-8,10H2,1-2H3,(H2,18,19,22)/p+1/t11-/m1/s1