5-[(E)-2-(7-fluoranyl-1H-indol-4-yl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine

Systemtic Name: 5-[(E)-2-(7-fluoranyl-1H-indol-4-yl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine Openeye Name: 5-[(E)-2-(7-fluoro-1H-indol-4-yl)vinyl]-N-[4-(4-piperidylsulfonyl)phenyl]pyrimidin-2-amine CAS Name: 5-[(E)-2-(7-fluoro-1H-indol-4-yl)ethenyl]-N-[4-(4-piperidinylsulfonyl)phenyl]-2-pyrimidinamine IUPAC Name: 5-[(E)-2-(7-fluoro-1H-indol-4-yl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine Traditional Name: [5-[(E)-2-(7-fluoro-1H-indol-4-yl)vinyl]pyrimidin-2-yl]-[4-(4-piperidylsulfonyl)phenyl]amine Formula: C25H24FN5O2S MolecularWeight: 477.553763

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1S(=O)(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C=CC4=C5C=CNC5=C(C=C4)F

Isomeric SMILES

C1CNCCC1S(=O)(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)/C=C/C4=C5C=CNC5=C(C=C4)F

InChI

InChI=1S/C25H24FN5O2S/c26-23-8-3-18(22-11-14-28-24(22)23)2-1-17-15-29-25(30-16-17)31-19-4-6-20(7-5-19)34(32,33)21-9-12-27-13-10-21/h1-8,11,14-16,21,27-28H,9-10,12-13H2,(H,29,30,31)/b2-1+