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

Systemtic Name: 1-(4-methoxyphenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea Traditional Name: 1-(4-methoxyphenyl)-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]thiourea Formula: C16H28N4OS+2 MolecularWeight: 324.48472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4OS/c1-19-10-12-20(13-11-19)9-3-8-17-16(22)18-14-4-6-15(21-2)7-5-14/h4-7H,3,8-13H2,1-2H3,(H2,17,18,22)/p+2