1-(3-chloranyl-4-fluoranyl-phenyl)-3-pentyl-thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-pentyl-thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-pentyl-thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-pentylthiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-pentylthiourea Traditional Name: 1-amyl-3-(3-chloro-4-fluoro-phenyl)thiourea Formula: C12H16ClFN2S MolecularWeight: 274.785243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NC1=CC(=C(C=C1)F)Cl

Isomeric SMILES

CCCCCNC(=S)NC1=CC(=C(C=C1)F)Cl

InChI

InChI=1S/C12H16ClFN2S/c1-2-3-4-7-15-12(17)16-9-5-6-11(14)10(13)8-9/h5-6,8H,2-4,7H2,1H3,(H2,15,16,17)