1-(3-bromophenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea

Systemtic Name: 1-(3-bromophenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea Openeye Name: 1-(3-bromophenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea CAS Name: 1-(3-bromophenyl)-3-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]thiourea IUPAC Name: 1-(3-bromophenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea Traditional Name: 1-(3-bromophenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea Formula: C15H25BrN4S+2 MolecularWeight: 373.3548

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCNC(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCNC(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H23BrN4S/c1-19-8-10-20(11-9-19)7-3-6-17-15(21)18-14-5-2-4-13(16)12-14/h2,4-5,12H,3,6-11H2,1H3,(H2,17,18,21)/p+2