1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]thiourea Formula: C19H24FN4S+ MolecularWeight: 359.484063

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN4S/c1-23-10-12-24(13-11-23)18-5-3-2-4-17(18)22-19(25)21-14-15-6-8-16(20)9-7-15/h2-9H,10-14H2,1H3,(H2,21,22,25)/p+1