1-[(4-methoxyphenyl)methyl]-3-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]thiourea

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]thiourea Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]thiourea CAS Name: 1-[(4-methoxyphenyl)methyl]-3-[3-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]propyl]thiourea IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]thiourea Traditional Name: 1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-p-anisyl-thiourea Formula: C23H33N4O2S+ MolecularWeight: 429.59872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NCCC[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NCCC[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H32N4O2S/c1-28-21-8-4-19(5-9-21)18-25-23(30)24-12-3-13-26-14-16-27(17-15-26)20-6-10-22(29-2)11-7-20/h4-11H,3,12-18H2,1-2H3,(H2,24,25,30)/p+1