N-(1-adamantyl)-2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]propanamide

Systemtic Name: N-(1-adamantyl)-2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]propanamide Openeye Name: N-(1-adamantyl)-2-[5-(4-bromophenyl)tetrazol-2-yl]propanamide CAS Name: N-(1-adamantyl)-2-[5-(4-bromophenyl)-2-tetrazolyl]propanamide IUPAC Name: N-(1-adamantyl)-2-[5-(4-bromophenyl)tetrazol-2-yl]propanamide Traditional Name: N-(1-adamantyl)-2-[5-(4-bromophenyl)tetrazol-2-yl]propionamide Formula: C20H24BrN5O MolecularWeight: 430.34146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)N4N=C(N=N4)C5=CC=C(C=C5)Br

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)N4N=C(N=N4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C20H24BrN5O/c1-12(26-24-18(23-25-26)16-2-4-17(21)5-3-16)19(27)22-20-9-13-6-14(10-20)8-15(7-13)11-20/h2-5,12-15H,6-11H2,1H3,(H,22,27)