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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=N1)C23CC4CC(C2)CC(C4)(C3)CC(=O)NC5=CC=C(C=C5)Br

Isomeric SMILES

CC1=NN(N=N1)C23CC4CC(C2)CC(C4)(C3)CC(=O)NC5=CC=C(C=C5)Br

InChI

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