1-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]propyl]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]propyl]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]propyl]thiourea CAS Name: 1-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]propyl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]propyl]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]propyl]thiourea Formula: C20H25ClFN4S+ MolecularWeight: 407.955703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCNC(=S)NC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CCCNC(=S)NC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H24ClFN4S/c21-16-2-6-18(7-3-16)24-20(27)23-10-1-11-25-12-14-26(15-13-25)19-8-4-17(22)5-9-19/h2-9H,1,10-15H2,(H2,23,24,27)/p+1