2-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-5-(6-methylquinolin-2-yl)-1,3,4-oxadiazole

Systemtic Name: 2-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-5-(6-methylquinolin-2-yl)-1,3,4-oxadiazole Openeye Name: 2-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-5-(6-methyl-2-quinolyl)-1,3,4-oxadiazole CAS Name: 2-[3-(1-adamantyl)-1-phenyl-4-pyrazolyl]-5-(6-methyl-2-quinolinyl)-1,3,4-oxadiazole IUPAC Name: 2-[3-(1-adamantyl)-1-phenylpyrazol-4-yl]-5-(6-methylquinolin-2-yl)-1,3,4-oxadiazole Traditional Name: 2-[3-(1-adamantyl)-1-phenyl-pyrazol-4-yl]-5-(6-methyl-2-quinolyl)-1,3,4-oxadiazole Formula: C31H29N5O MolecularWeight: 487.59486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2)C3=NN=C(O3)C4=CN(N=C4C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2)C3=NN=C(O3)C4=CN(N=C4C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

InChI

InChI=1S/C31H29N5O/c1-19-7-9-26-23(11-19)8-10-27(32-26)30-34-33-29(37-30)25-18-36(24-5-3-2-4-6-24)35-28(25)31-15-20-12-21(16-31)14-22(13-20)17-31/h2-11,18,20-22H,12-17H2,1H3