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

Systemtic Name: N-[2,6-bis(bromanyl)-4-methyl-phenyl]-1-diphenylphosphoryl-methanethioamide Openeye Name: N-(2,6-dibromo-4-methyl-phenyl)-1-diphenylphosphoryl-thioformamide CAS Name: N-(2,6-dibromo-4-methylphenyl)-1-diphenylphosphorylmethanethioamide IUPAC Name: N-(2,6-dibromo-4-methylphenyl)-1-diphenylphosphorylmethanethioamide Traditional Name: N-(2,6-dibromo-4-methyl-phenyl)-1-diphenylphosphoryl-thioformamide Formula: C20H16Br2NOPS MolecularWeight: 509.193901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=S)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=S)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C20H16Br2NOPS/c1-14-12-17(21)19(18(22)13-14)23-20(26)25(24,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13H,1H3,(H,23,26)