6-[(2R)-1-[(3R)-4-(2-chloranyl-4-cyano-phenyl)-3-(4-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propan-2-yl]-N-(2-hydroxyethyl)pyridine-3-carboxamide

Systemtic Name: 6-[(2R)-1-[(3R)-4-(2-chloranyl-4-cyano-phenyl)-3-(4-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propan-2-yl]-N-(2-hydroxyethyl)pyridine-3-carboxamide Openeye Name: 6-[(1R)-2-[(3R)-4-(2-chloro-4-cyano-phenyl)-3-(4-chlorophenyl)piperazin-1-yl]-1-hydroxy-1-methyl-ethyl]-N-(2-hydroxyethyl)pyridine-3-carboxamide CAS Name: 6-[(2R)-1-[(3R)-4-(2-chloro-4-cyanophenyl)-3-(4-chlorophenyl)-1-piperazinyl]-2-hydroxypropan-2-yl]-N-(2-hydroxyethyl)-3-pyridinecarboxamide IUPAC Name: 6-[(2R)-1-[(3R)-4-(2-chloro-4-cyanophenyl)-3-(4-chlorophenyl)piperazin-1-yl]-2-hydroxypropan-2-yl]-N-(2-hydroxyethyl)pyridine-3-carboxamide Traditional Name: 6-[(1R)-2-[(3R)-4-(2-chloro-4-cyano-phenyl)-3-(4-chlorophenyl)piperazino]-1-hydroxy-1-methyl-ethyl]-N-(2-hydroxyethyl)nicotinamide Formula: C28H29Cl2N5O3 MolecularWeight: 554.46756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(C(C1)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C#N)Cl)(C4=NC=C(C=C4)C(=O)NCCO)O

Isomeric SMILES

C[C@@](CN1CCN([C@@H](C1)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C#N)Cl)(C4=NC=C(C=C4)C(=O)NCCO)O

InChI

InChI=1S/C28H29Cl2N5O3/c1-28(38,26-9-5-21(16-33-26)27(37)32-10-13-36)18-34-11-12-35(24-8-2-19(15-31)14-23(24)30)25(17-34)20-3-6-22(29)7-4-20/h2-9,14,16,25,36,38H,10-13,17-18H2,1H3,(H,32,37)/t25-,28+/m0/s1