4-(4-chlorophenyl)-1-[(E)-4-pyridin-3-yl-4-pyrimidin-4-yl-but-3-enyl]piperidin-4-ol

Systemtic Name: 4-(4-chlorophenyl)-1-[(E)-4-pyridin-3-yl-4-pyrimidin-4-yl-but-3-enyl]piperidin-4-ol Openeye Name: 4-(4-chlorophenyl)-1-[(E)-4-(3-pyridyl)-4-pyrimidin-4-yl-but-3-enyl]piperidin-4-ol CAS Name: 4-(4-chlorophenyl)-1-[(E)-4-(3-pyridinyl)-4-(4-pyrimidinyl)but-3-enyl]-4-piperidinol IUPAC Name: 4-(4-chlorophenyl)-1-[(E)-4-pyridin-3-yl-4-pyrimidin-4-ylbut-3-enyl]piperidin-4-ol Traditional Name: 4-(4-chlorophenyl)-1-[(E)-4-(3-pyridyl)-4-(4-pyrimidyl)but-3-enyl]piperidin-4-ol Formula: C24H25ClN4O MolecularWeight: 420.9345

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCC=C(C3=CN=CC=C3)C4=NC=NC=C4

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CC/C=C(\C3=CN=CC=C3)/C4=NC=NC=C4

InChI

InChI=1S/C24H25ClN4O/c25-21-7-5-20(6-8-21)24(30)10-15-29(16-11-24)14-2-4-22(19-3-1-12-26-17-19)23-9-13-27-18-28-23/h1,3-9,12-13,17-18,30H,2,10-11,14-16H2/b22-4+