4-chloranyl-N-[2-(2-dimorpholin-4-ylphosphinothioylimidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(2-dimorpholin-4-ylphosphinothioylimidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-chloro-N-[2-(2-dimorpholinophosphinothioylimidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: N-[2-[2-[bis(4-morpholinyl)phosphinothioyl]-1-imidazolyl]-5-(trifluoromethyl)phenyl]-4-chlorobenzamide IUPAC Name: 4-chloro-N-[2-(2-dimorpholin-4-ylphosphinothioylimidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-chloro-N-[2-(2-dimorpholinothiophosphorylimidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide Formula: C25H26ClF3N5O3PS MolecularWeight: 599.992611

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1P(=S)(C2=NC=CN2C3=C(C=C(C=C3)C(F)(F)F)NC(=O)C4=CC=C(C=C4)Cl)N5CCOCC5

Isomeric SMILES

C1COCCN1P(=S)(C2=NC=CN2C3=C(C=C(C=C3)C(F)(F)F)NC(=O)C4=CC=C(C=C4)Cl)N5CCOCC5

InChI

InChI=1S/C25H26ClF3N5O3PS/c26-20-4-1-18(2-5-20)23(35)31-21-17-19(25(27,28)29)3-6-22(21)34-8-7-30-24(34)38(39,32-9-13-36-14-10-32)33-11-15-37-16-12-33/h1-8,17H,9-16H2,(H,31,35)