N-[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[6-(piperidin-1-ylmethyl)pyridin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-amine

Systemtic Name: N-[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[6-(piperidin-1-ylmethyl)pyridin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-amine Openeye Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[6-(1-piperidylmethyl)-2-pyridyl]ethynyl]thieno[3,2-d]pyrimidin-4-amine CAS Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[6-(1-piperidinylmethyl)-2-pyridinyl]ethynyl]-4-thieno[3,2-d]pyrimidinamine IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[6-(piperidin-1-ylmethyl)pyridin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-amine Traditional Name: [3-chloro-4-(3-fluorobenzyl)oxy-phenyl]-[6-[2-[6-(piperidinomethyl)-2-pyridyl]ethynyl]thieno[3,2-d]pyrimidin-4-yl]amine Formula: C32H27ClFN5OS MolecularWeight: 584.106083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC(=N2)C#CC3=CC4=C(S3)C(=NC=N4)NC5=CC(=C(C=C5)OCC6=CC(=CC=C6)F)Cl

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC(=N2)C#CC3=CC4=C(S3)C(=NC=N4)NC5=CC(=C(C=C5)OCC6=CC(=CC=C6)F)Cl

InChI

InChI=1S/C32H27ClFN5OS/c33-28-17-25(11-13-30(28)40-20-22-6-4-7-23(34)16-22)38-32-31-29(35-21-36-32)18-27(41-31)12-10-24-8-5-9-26(37-24)19-39-14-2-1-3-15-39/h4-9,11,13,16-18,21H,1-3,14-15,19-20H2,(H,35,36,38)