3-(3-chloranyl-4-fluoranyl-phenyl)-1-ethyl-1-(2-pyridin-4-ylethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-ethyl-1-(2-pyridin-4-ylethyl)thiourea Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-1-ethyl-1-[2-(4-pyridyl)ethyl]thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-ethyl-1-(2-pyridin-4-ylethyl)thiourea IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-ethyl-1-(2-pyridin-4-ylethyl)thiourea Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-1-ethyl-1-[2-(4-pyridyl)ethyl]thiourea Formula: C16H17ClFN3S MolecularWeight: 337.842683

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CC=NC=C1)C(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCN(CCC1=CC=NC=C1)C(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H17ClFN3S/c1-2-21(10-7-12-5-8-19-9-6-12)16(22)20-13-3-4-15(18)14(17)11-13/h3-6,8-9,11H,2,7,10H2,1H3,(H,20,22)