[4-[[(5-ethynylpyrimidin-2-yl)amino]methyl]piperidin-1-yl]-(2-phenylcyclopropyl)methanone

Systemtic Name: [4-[[(5-ethynylpyrimidin-2-yl)amino]methyl]piperidin-1-yl]-(2-phenylcyclopropyl)methanone Openeye Name: [4-[[(5-ethynylpyrimidin-2-yl)amino]methyl]-1-piperidyl]-(2-phenylcyclopropyl)methanone CAS Name: [4-[[(5-ethynyl-2-pyrimidinyl)amino]methyl]-1-piperidinyl]-(2-phenylcyclopropyl)methanone IUPAC Name: [4-[[(5-ethynylpyrimidin-2-yl)amino]methyl]piperidin-1-yl]-(2-phenylcyclopropyl)methanone Traditional Name: [4-[[(5-ethynylpyrimidin-2-yl)amino]methyl]piperidino]-(2-phenylcyclopropyl)methanone Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CN=C(N=C1)NCC2CCN(CC2)C(=O)C3CC3C4=CC=CC=C4

Isomeric SMILES

C#CC1=CN=C(N=C1)NCC2CCN(CC2)C(=O)C3CC3C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O/c1-2-16-13-23-22(24-14-16)25-15-17-8-10-26(11-9-17)21(27)20-12-19(20)18-6-4-3-5-7-18/h1,3-7,13-14,17,19-20H,8-12,15H2,(H,23,24,25)