1-(4-ethoxyphenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea

Systemtic Name: 1-(4-ethoxyphenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Openeye Name: 1-(4-ethoxyphenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea CAS Name: 1-(4-ethoxyphenyl)-3-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]thiourea IUPAC Name: 1-(4-ethoxyphenyl)-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Traditional Name: 1-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-p-phenetyl-thiourea Formula: C16H26N3OS+ MolecularWeight: 308.46214

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=S)NC2=CC=C(C=C2)OCC

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC(=S)NC2=CC=C(C=C2)OCC

InChI

InChI=1S/C16H25N3OS/c1-3-19-11-5-6-14(19)12-17-16(21)18-13-7-9-15(10-8-13)20-4-2/h7-10,14H,3-6,11-12H2,1-2H3,(H2,17,18,21)/p+1/t14-/m1/s1