3-[(4-methoxyphenyl)methyl]-1-methyl-1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]thiourea

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-1-methyl-1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]thiourea Openeye Name: 3-[(4-methoxyphenyl)methyl]-1-methyl-1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]thiourea CAS Name: 3-[(4-methoxyphenyl)methyl]-1-methyl-1-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]thiourea IUPAC Name: 3-[(4-methoxyphenyl)methyl]-1-methyl-1-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]thiourea Traditional Name: 1-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-1-methyl-3-p-anisyl-thiourea Formula: C17H27N4O2S+ MolecularWeight: 351.48688

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(C)C(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(C)C(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H26N4O2S/c1-19-8-10-21(11-9-19)16(22)13-20(2)17(24)18-12-14-4-6-15(23-3)7-5-14/h4-7H,8-13H2,1-3H3,(H,18,24)/p+1