1-(4-methylpiperazin-4-ium-1-yl)-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(4-phenoxyphenyl)thiourea CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(4-phenoxyphenyl)thiourea Formula: C18H23N4OS+ MolecularWeight: 343.46642

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H22N4OS/c1-21-11-13-22(14-12-21)20-18(24)19-15-7-9-17(10-8-15)23-16-5-3-2-4-6-16/h2-10H,11-14H2,1H3,(H2,19,20,24)/p+1