N-(1-adamantyl)-2-(3-cyano-1,2,4-triazol-4-yl)-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-(3-cyano-1,2,4-triazol-4-yl)-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: N-(1-adamantyl)-2-(3-cyano-1,2,4-triazol-4-yl)-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: N-(1-adamantyl)-2-(3-cyano-1,2,4-triazol-4-yl)-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: N-(1-adamantyl)-2-(3-cyano-1,2,4-triazol-4-yl)-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: N-(1-adamantyl)-2-(3-cyano-1,2,4-triazol-4-yl)-N-m-anisyl-acetamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C(=O)CN2C=NN=C2C#N)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1)CN(C(=O)CN2C=NN=C2C#N)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H27N5O2/c1-30-20-4-2-3-16(8-20)13-28(22(29)14-27-15-25-26-21(27)12-24)23-9-17-5-18(10-23)7-19(6-17)11-23/h2-4,8,15,17-19H,5-7,9-11,13-14H2,1H3