N-[(2R)-3-ethyl-2-morpholin-4-yl-pentyl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(2R)-3-ethyl-2-morpholin-4-yl-pentyl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[(2R)-3-ethyl-2-morpholino-pentyl]-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[(2R)-3-ethyl-2-(4-morpholinyl)pentyl]-1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[(2R)-3-ethyl-2-morpholino-pentyl]-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C27H35N5O2 MolecularWeight: 461.5991

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1=CN(N=C1C2=CN=CC=C2)CC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CCC(CC)[C@H](CNC(=O)C1=CN(N=C1C2=CN=CC=C2)CC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C27H35N5O2/c1-3-22(4-2)25(31-13-15-34-16-14-31)18-29-27(33)24-20-32(19-21-9-6-5-7-10-21)30-26(24)23-11-8-12-28-17-23/h5-12,17,20,22,25H,3-4,13-16,18-19H2,1-2H3,(H,29,33)/t25-/m0/s1