N-(2-adamantyl)-4-[4-(pyrimidin-2-ylmethoxy)phenyl]-2,3-dihydroquinoxaline-1-carboxamide

Systemtic Name: N-(2-adamantyl)-4-[4-(pyrimidin-2-ylmethoxy)phenyl]-2,3-dihydroquinoxaline-1-carboxamide Openeye Name: N-(2-adamantyl)-4-[4-(pyrimidin-2-ylmethoxy)phenyl]-2,3-dihydroquinoxaline-1-carboxamide CAS Name: N-(2-adamantyl)-4-[4-(2-pyrimidinylmethoxy)phenyl]-2,3-dihydroquinoxaline-1-carboxamide IUPAC Name: N-(2-adamantyl)-4-[4-(pyrimidin-2-ylmethoxy)phenyl]-2,3-dihydroquinoxaline-1-carboxamide Traditional Name: N-(2-adamantyl)-4-[4-(2-pyrimidylmethoxy)phenyl]-2,3-dihydroquinoxaline-1-carboxamide Formula: C30H33N5O2 MolecularWeight: 495.61532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2N1C3=CC=C(C=C3)OCC4=NC=CC=N4)C(=O)NC5C6CC7CC(C6)CC5C7

Isomeric SMILES

C1CN(C2=CC=CC=C2N1C3=CC=C(C=C3)OCC4=NC=CC=N4)C(=O)NC5C6CC7CC(C6)CC5C7

InChI

InChI=1S/C30H33N5O2/c36-30(33-29-22-15-20-14-21(17-22)18-23(29)16-20)35-13-12-34(26-4-1-2-5-27(26)35)24-6-8-25(9-7-24)37-19-28-31-10-3-11-32-28/h1-11,20-23,29H,12-19H2,(H,33,36)