3-(1H-indol-3-yl)-1-[4-[5-[(E)-prop-1-enyl]-2-pyridin-3-yl-pyrimidin-4-yl]piperidin-1-yl]propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[4-[5-[(E)-prop-1-enyl]-2-pyridin-3-yl-pyrimidin-4-yl]piperidin-1-yl]propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[4-[5-[(E)-prop-1-enyl]-2-(3-pyridyl)pyrimidin-4-yl]-1-piperidyl]propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[4-[5-[(E)-prop-1-enyl]-2-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[4-[5-[(E)-prop-1-enyl]-2-pyridin-3-ylpyrimidin-4-yl]piperidin-1-yl]propan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[4-[5-[(E)-prop-1-enyl]-2-(3-pyridyl)pyrimidin-4-yl]piperidino]propan-1-one Formula: C28H29N5O MolecularWeight: 451.56276

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CN=C(N=C1C2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C/C=C/C1=CN=C(N=C1C2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C28H29N5O/c1-2-6-22-19-31-28(23-7-5-14-29-17-23)32-27(22)20-12-15-33(16-13-20)26(34)11-10-21-18-30-25-9-4-3-8-24(21)25/h2-9,14,17-20,30H,10-13,15-16H2,1H3/b6-2+