1-chloranyl-3-(trifluoromethyl)benzene; 4-isocyanatobenzenethiol

Systemtic Name: 1-chloranyl-3-(trifluoromethyl)benzene; 4-isocyanatobenzenethiol Openeye Name: 1-chloro-3-(trifluoromethyl)benzene; 4-isocyanatobenzenethiol CAS Name: 1-chloro-3-(trifluoromethyl)benzene; 4-isocyanatobenzenethiol IUPAC Name: 1-chloro-3-(trifluoromethyl)benzene; 4-isocyanatobenzenethiol Traditional Name: 1-chloro-3-(trifluoromethyl)benzene; 4-isocyanatobenzenethiol Formula: C14H9ClF3NOS MolecularWeight: 331.74057

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(F)(F)F.C1=CC(=CC=C1N=C=O)S

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(F)(F)F.C1=CC(=CC=C1N=C=O)S

InChI

InChI=1S/C7H4ClF3.C7H5NOS/c8-6-3-1-2-5(4-6)7(9,10)11;9-5-8-6-1-3-7(10)4-2-6/h1-4H;1-4,10H