1-(2-ethylphenyl)-3-(3-pyrrolidin-1-ium-1-ylpropyl)thiourea

Systemtic Name: 1-(2-ethylphenyl)-3-(3-pyrrolidin-1-ium-1-ylpropyl)thiourea Openeye Name: 1-(2-ethylphenyl)-3-(3-pyrrolidin-1-ium-1-ylpropyl)thiourea CAS Name: 1-(2-ethylphenyl)-3-[3-(1-pyrrolidin-1-iumyl)propyl]thiourea IUPAC Name: 1-(2-ethylphenyl)-3-(3-pyrrolidin-1-ium-1-ylpropyl)thiourea Traditional Name: 1-(2-ethylphenyl)-3-(3-pyrrolidin-1-ium-1-ylpropyl)thiourea Formula: C16H26N3S+ MolecularWeight: 292.46274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NCCC[NH+]2CCCC2

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NCCC[NH+]2CCCC2

InChI

InChI=1S/C16H25N3S/c1-2-14-8-3-4-9-15(14)18-16(20)17-10-7-13-19-11-5-6-12-19/h3-4,8-9H,2,5-7,10-13H2,1H3,(H2,17,18,20)/p+1