4-(3-dimorpholin-4-ylphosphinothioyl-2,5-dimethyl-pyrrol-1-yl)-N,N-dimethyl-aniline

Systemtic Name: 4-(3-dimorpholin-4-ylphosphinothioyl-2,5-dimethyl-pyrrol-1-yl)-N,N-dimethyl-aniline Openeye Name: 4-(3-dimorpholinophosphinothioyl-2,5-dimethyl-pyrrol-1-yl)-N,N-dimethyl-aniline CAS Name: 4-[3-[bis(4-morpholinyl)phosphinothioyl]-2,5-dimethyl-1-pyrrolyl]-N,N-dimethylaniline IUPAC Name: 4-(3-dimorpholin-4-ylphosphinothioyl-2,5-dimethylpyrrol-1-yl)-N,N-dimethylaniline Traditional Name: [4-(3-dimorpholinothiophosphoryl-2,5-dimethyl-pyrrol-1-yl)phenyl]-dimethyl-amine Formula: C22H33N4O2PS MolecularWeight: 448.561781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)N(C)C)C)P(=S)(N3CCOCC3)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)N(C)C)C)P(=S)(N3CCOCC3)N4CCOCC4

InChI

InChI=1S/C22H33N4O2PS/c1-18-17-22(19(2)26(18)21-7-5-20(6-8-21)23(3)4)29(30,24-9-13-27-14-10-24)25-11-15-28-16-12-25/h5-8,17H,9-16H2,1-4H3