3,6-bis(1-methylpyrazol-4-yl)-4-[2-[(2S)-piperidin-2-yl]ethoxy]quinoline

Systemtic Name: 3,6-bis(1-methylpyrazol-4-yl)-4-[2-[(2S)-piperidin-2-yl]ethoxy]quinoline Openeye Name: 3,6-bis(1-methylpyrazol-4-yl)-4-[2-[(2S)-2-piperidyl]ethoxy]quinoline CAS Name: 3,6-bis(1-methyl-4-pyrazolyl)-4-[2-[(2S)-2-piperidinyl]ethoxy]quinoline IUPAC Name: 3,6-bis(1-methylpyrazol-4-yl)-4-[2-[(2S)-piperidin-2-yl]ethoxy]quinoline Traditional Name: 3,6-bis(1-methylpyrazol-4-yl)-4-[2-[(2S)-2-piperidyl]ethoxy]quinoline Formula: C24H28N6O MolecularWeight: 416.51872

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC3=C(C(=CN=C3C=C2)C4=CN(N=C4)C)OCCC5CCCCN5

Isomeric SMILES

CN1C=C(C=N1)C2=CC3=C(C(=CN=C3C=C2)C4=CN(N=C4)C)OCC[C@@H]5CCCCN5

InChI

InChI=1S/C24H28N6O/c1-29-15-18(12-27-29)17-6-7-23-21(11-17)24(31-10-8-20-5-3-4-9-25-20)22(14-26-23)19-13-28-30(2)16-19/h6-7,11-16,20,25H,3-5,8-10H2,1-2H3/t20-/m0/s1