N-(2,5-dimethylphenyl)-3-(5-methyl-1,2,3,4-tetrazol-2-yl)adamantane-1-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-(5-methyl-1,2,3,4-tetrazol-2-yl)adamantane-1-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-3-(5-methyltetrazol-2-yl)adamantane-1-carboxamide CAS Name: N-(2,5-dimethylphenyl)-3-(5-methyl-2-tetrazolyl)-1-adamantanecarboxamide IUPAC Name: N-(2,5-dimethylphenyl)-3-(5-methyltetrazol-2-yl)adamantane-1-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-3-(5-methyltetrazol-2-yl)adamantane-1-carboxamide Formula: C21H27N5O MolecularWeight: 365.47198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5N=C(N=N5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5N=C(N=N5)C

InChI

InChI=1S/C21H27N5O/c1-13-4-5-14(2)18(6-13)22-19(27)20-8-16-7-17(9-20)11-21(10-16,12-20)26-24-15(3)23-25-26/h4-6,16-17H,7-12H2,1-3H3,(H,22,27)