N-(3-methylphenyl)-2-[3-(5-methyl-1,2,3,4-tetrazol-2-yl)-1-adamantyl]ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[3-(5-methyl-1,2,3,4-tetrazol-2-yl)-1-adamantyl]ethanamide Openeye Name: 2-[3-(5-methyltetrazol-2-yl)-1-adamantyl]-N-(m-tolyl)acetamide CAS Name: N-(3-methylphenyl)-2-[3-(5-methyl-2-tetrazolyl)-1-adamantyl]acetamide IUPAC Name: N-(3-methylphenyl)-2-[3-(5-methyltetrazol-2-yl)-1-adamantyl]acetamide Traditional Name: 2-[3-(5-methyltetrazol-2-yl)-1-adamantyl]-N-(m-tolyl)acetamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)N5N=C(N=N5)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)N5N=C(N=N5)C

InChI

InChI=1S/C21H27N5O/c1-14-4-3-5-18(6-14)22-19(27)12-20-8-16-7-17(9-20)11-21(10-16,13-20)26-24-15(2)23-25-26/h3-6,16-17H,7-13H2,1-2H3,(H,22,27)