1-[2,4-bis(fluoranyl)phenyl]-3-(4-methylpiperazin-4-ium-1-yl)thiourea

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-3-(4-methylpiperazin-4-ium-1-yl)thiourea Openeye Name: 1-(2,4-difluorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea CAS Name: 1-(2,4-difluorophenyl)-3-(4-methyl-1-piperazin-4-iumyl)thiourea IUPAC Name: 1-(2,4-difluorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea Traditional Name: 1-(2,4-difluorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea Formula: C12H17F2N4S+ MolecularWeight: 287.351986

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=S)NC2=C(C=C(C=C2)F)F

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=S)NC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C12H16F2N4S/c1-17-4-6-18(7-5-17)16-12(19)15-11-3-2-9(13)8-10(11)14/h2-3,8H,4-7H2,1H3,(H2,15,16,19)/p+1