1-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-3-(3,4-dimethylphenyl)thiourea

Systemtic Name: 1-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-3-(3,4-dimethylphenyl)thiourea Openeye Name: 1-[(3-bromo-4-fluoro-phenyl)methyl]-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-[(3-bromo-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-[(3-bromo-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-(3-bromo-4-fluoro-benzyl)-3-(3,4-dimethylphenyl)thiourea Formula: C16H16BrFN2S MolecularWeight: 367.279043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC2=CC(=C(C=C2)F)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC2=CC(=C(C=C2)F)Br)C

InChI

InChI=1S/C16H16BrFN2S/c1-10-3-5-13(7-11(10)2)20-16(21)19-9-12-4-6-15(18)14(17)8-12/h3-8H,9H2,1-2H3,(H2,19,20,21)