N-[4-[2-[(2-phenylazanylpyridin-4-yl)methyl]cyclohexyl]piperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: N-[4-[2-[(2-phenylazanylpyridin-4-yl)methyl]cyclohexyl]piperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-[4-[2-[(2-anilino-4-pyridyl)methyl]cyclohexyl]piperazin-1-yl]-N-isopropyl-acetamide CAS Name: N-[4-[2-[(2-anilino-4-pyridinyl)methyl]cyclohexyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: N-[4-[2-[(2-anilinopyridin-4-yl)methyl]cyclohexyl]piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: N-[4-[2-[(2-anilino-4-pyridyl)methyl]cyclohexyl]piperazino]-N-isopropyl-acetamide Formula: C27H39N5O MolecularWeight: 449.63146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)C)N1CCN(CC1)C2CCCCC2CC3=CC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC(C)N(C(=O)C)N1CCN(CC1)C2CCCCC2CC3=CC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C27H39N5O/c1-21(2)32(22(3)33)31-17-15-30(16-18-31)26-12-8-7-9-24(26)19-23-13-14-28-27(20-23)29-25-10-5-4-6-11-25/h4-6,10-11,13-14,20-21,24,26H,7-9,12,15-19H2,1-3H3,(H,28,29)