N-(2,6-dimethylphenyl)-1-diphenylphosphoryl-methanethioamide

Systemtic Name: N-(2,6-dimethylphenyl)-1-diphenylphosphoryl-methanethioamide Openeye Name: N-(2,6-dimethylphenyl)-1-diphenylphosphoryl-thioformamide CAS Name: N-(2,6-dimethylphenyl)-1-diphenylphosphorylmethanethioamide IUPAC Name: N-(2,6-dimethylphenyl)-1-diphenylphosphorylmethanethioamide Traditional Name: N-(2,6-dimethylphenyl)-1-diphenylphosphoryl-thioformamide Formula: C21H20NOPS MolecularWeight: 365.428361

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20NOPS/c1-16-10-9-11-17(2)20(16)22-21(25)24(23,18-12-5-3-6-13-18)19-14-7-4-8-15-19/h3-15H,1-2H3,(H,22,25)