3-(1-adamantyl)-1-phenyl-N-(3-propan-2-yloxypropyl)pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-1-phenyl-N-(3-propan-2-yloxypropyl)pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-(3-isopropoxypropyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-1-phenyl-N-(3-propan-2-yloxypropyl)-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-1-phenyl-N-(3-propan-2-yloxypropyl)pyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-(3-isopropoxypropyl)-1-phenyl-pyrazole-4-carboxamide Formula: C26H35N3O2 MolecularWeight: 421.575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1=CN(N=C1C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

Isomeric SMILES

CC(C)OCCCNC(=O)C1=CN(N=C1C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

InChI

InChI=1S/C26H35N3O2/c1-18(2)31-10-6-9-27-25(30)23-17-29(22-7-4-3-5-8-22)28-24(23)26-14-19-11-20(15-26)13-21(12-19)16-26/h3-5,7-8,17-21H,6,9-16H2,1-2H3,(H,27,30)