N-[2,6-bis(bromanyl)-3-chloranyl-4-methyl-phenyl]-1-diphenylphosphoryl-methanethioamide

Systemtic Name: N-[2,6-bis(bromanyl)-3-chloranyl-4-methyl-phenyl]-1-diphenylphosphoryl-methanethioamide Openeye Name: N-(2,6-dibromo-3-chloro-4-methyl-phenyl)-1-diphenylphosphoryl-thioformamide CAS Name: N-(2,6-dibromo-3-chloro-4-methylphenyl)-1-diphenylphosphorylmethanethioamide IUPAC Name: N-(2,6-dibromo-3-chloro-4-methylphenyl)-1-diphenylphosphorylmethanethioamide Traditional Name: N-(2,6-dibromo-3-chloro-4-methyl-phenyl)-1-diphenylphosphoryl-thioformamide Formula: C20H15Br2ClNOPS MolecularWeight: 543.638961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)Br)NC(=S)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)Br)NC(=S)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C20H15Br2ClNOPS/c1-13-12-16(21)19(17(22)18(13)23)24-20(27)26(25,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-12H,1H3,(H,24,27)