N-[(1S,2R,5R)-2-[2-cyanoethyl-[di(propan-2-yl)amino]phosphanyl]oxy-5-(9-phenylxanthen-9-yl)oxy-cyclopentyl]-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanamide

Systemtic Name: N-[(1S,2R,5R)-2-[2-cyanoethyl-[di(propan-2-yl)amino]phosphanyl]oxy-5-(9-phenylxanthen-9-yl)oxy-cyclopentyl]-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanamide Openeye Name: N-[(1S,2R,5R)-2-[2-cyanoethyl-(diisopropylamino)phosphanyl]oxy-5-(9-phenylxanthen-9-yl)oxy-cyclopentyl]-2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)acetamide CAS Name: N-[(1S,2R,5R)-2-[2-cyanoethyl-[di(propan-2-yl)amino]phosphino]oxy-5-[(9-phenyl-9-xanthenyl)oxy]cyclopentyl]-2-(5-methyl-2,4-dioxo-1-pyrimidinyl)acetamide IUPAC Name: N-[(1S,2R,5R)-2-[2-cyanoethyl-[di(propan-2-yl)amino]phosphanyl]oxy-5-(9-phenylxanthen-9-yl)oxycyclopentyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide Traditional Name: N-[(1S,2R,5R)-2-[2-cyanoethyl-(diisopropylamino)phosphino]oxy-5-(9-phenylxanthen-9-yl)oxy-cyclopentyl]-2-(2,4-diketo-5-methyl-pyrimidin-1-yl)acetamide Formula: C40H46N5O6P MolecularWeight: 723.796901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CC(=O)NC2C(CCC2OP(CCC#N)N(C(C)C)C(C)C)OC3(C4=CC=CC=C4OC5=CC=CC=C53)C6=CC=CC=C6

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CC(=O)N[C@H]2[C@@H](CC[C@H]2OP(CCC#N)N(C(C)C)C(C)C)OC3(C4=CC=CC=C4OC5=CC=CC=C53)C6=CC=CC=C6

InChI

InChI=1S/C40H46N5O6P/c1-26(2)45(27(3)4)52(23-13-22-41)51-35-21-20-34(37(35)42-36(46)25-44-24-28(5)38(47)43-39(44)48)50-40(29-14-7-6-8-15-29)30-16-9-11-18-32(30)49-33-19-12-10-17-31(33)40/h6-12,14-19,24,26-27,34-35,37H,13,20-21,23,25H2,1-5H3,(H,42,46)(H,43,47,48)/t34-,35-,37+,52?/m1/s1