1-[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]-3-[(2S)-2-methylheptyl]thiourea

Systemtic Name: 1-[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]-3-[(2S)-2-methylheptyl]thiourea Openeye Name: 1-[(5-bromo-2-fluoro-benzoyl)amino]-3-[(2S)-2-methylheptyl]thiourea CAS Name: 1-[[(5-bromo-2-fluorophenyl)-oxomethyl]amino]-3-[(2S)-2-methylheptyl]thiourea IUPAC Name: 1-[(5-bromo-2-fluorobenzoyl)amino]-3-[(2S)-2-methylheptyl]thiourea Traditional Name: 1-[(5-bromo-2-fluoro-benzoyl)amino]-3-[(2S)-2-methylheptyl]thiourea Formula: C16H23BrFN3OS MolecularWeight: 404.340723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)C1=C(C=CC(=C1)Br)F

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=O)C1=C(C=CC(=C1)Br)F

InChI

InChI=1S/C16H23BrFN3OS/c1-3-4-5-6-11(2)10-19-16(23)21-20-15(22)13-9-12(17)7-8-14(13)18/h7-9,11H,3-6,10H2,1-2H3,(H,20,22)(H2,19,21,23)/t11-/m0/s1