N-(6,6-dimethyl-3-morpholin-4-yl-2-phenyl-4-piperidin-1-yl-5,7-dihydro-1,2,3$l^{5}-benzodiazaphosphol-3-ylidene)benzenesulfonamide

Systemtic Name: N-(6,6-dimethyl-3-morpholin-4-yl-2-phenyl-4-piperidin-1-yl-5,7-dihydro-1,2,3$l^{5}-benzodiazaphosphol-3-ylidene)benzenesulfonamide Openeye Name: N-[6,6-dimethyl-3-morpholino-2-phenyl-4-(1-piperidyl)-5,7-dihydro-1,2,3$l^{5}-benzodiazaphosphol-3-ylidene]benzenesulfonamide CAS Name: N-[6,6-dimethyl-3-(4-morpholinyl)-2-phenyl-4-(1-piperidinyl)-5,7-dihydro-1,2,3$l^{5}-benzodiazaphosphol-3-ylidene]benzenesulfonamide IUPAC Name: N-(6,6-dimethyl-3-morpholin-4-yl-2-phenyl-4-piperidin-1-yl-5,7-dihydro-1,2,3$l^{5}-benzodiazaphosphol-3-ylidene)benzenesulfonamide Traditional Name: N-(6,6-dimethyl-3-morpholino-2-phenyl-4-piperidino-5,7-dihydro-1,2,3$l^{5}-benzodiazaphosphol-3-ylidene)benzenesulfonamide Formula: C29H38N5O3PS MolecularWeight: 567.682481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C2C(=NN(P2(=NS(=O)(=O)C3=CC=CC=C3)N4CCOCC4)C5=CC=CC=C5)C1)N6CCCCC6)C

Isomeric SMILES

CC1(CC(=C2C(=NN(P2(=NS(=O)(=O)C3=CC=CC=C3)N4CCOCC4)C5=CC=CC=C5)C1)N6CCCCC6)C

InChI

InChI=1S/C29H38N5O3PS/c1-29(2)22-26-28(27(23-29)32-16-10-5-11-17-32)38(33-18-20-37-21-19-33,34(30-26)24-12-6-3-7-13-24)31-39(35,36)25-14-8-4-9-15-25/h3-4,6-9,12-15H,5,10-11,16-23H2,1-2H3