1-adamantyl-[5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]methanone

Systemtic Name: 1-adamantyl-[5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]methanone Openeye Name: 1-adamantyl-[5-(4-ethylphenyl)-3-isopropoxy-1,2,4-triazol-1-yl]methanone CAS Name: 1-adamantyl-[5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]methanone IUPAC Name: 1-adamantyl-[5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]methanone Traditional Name: 1-adamantyl-[5-(4-ethylphenyl)-3-isopropoxy-1,2,4-triazol-1-yl]methanone Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2C(=O)C34CC5CC(C3)CC(C5)C4)OC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2C(=O)C34CC5CC(C3)CC(C5)C4)OC(C)C

InChI

InChI=1S/C24H31N3O2/c1-4-16-5-7-20(8-6-16)21-25-23(29-15(2)3)26-27(21)22(28)24-12-17-9-18(13-24)11-19(10-17)14-24/h5-8,15,17-19H,4,9-14H2,1-3H3