1-(3-chloranyl-4-fluoranyl-phenyl)-3-pentan-2-yl-thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-pentan-2-yl-thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1-methylbutyl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-pentan-2-ylthiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-pentan-2-ylthiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1-methylbutyl)thiourea Formula: C12H16ClFN2S MolecularWeight: 274.785243

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=S)NC1=CC(=C(C=C1)F)Cl

Isomeric SMILES

CCCC(C)NC(=S)NC1=CC(=C(C=C1)F)Cl

InChI

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