5-methyl-N-[2-(1-phenyl-1,2,3,4-tetrazol-5-yl)-2-adamantyl]-1,2-oxazol-3-amine

Systemtic Name: 5-methyl-N-[2-(1-phenyl-1,2,3,4-tetrazol-5-yl)-2-adamantyl]-1,2-oxazol-3-amine Openeye Name: 5-methyl-N-[2-(1-phenyltetrazol-5-yl)-2-adamantyl]isoxazol-3-amine CAS Name: 5-methyl-N-[2-(1-phenyl-5-tetrazolyl)-2-adamantyl]-3-isoxazolamine IUPAC Name: 5-methyl-N-[2-(1-phenyltetrazol-5-yl)-2-adamantyl]-1,2-oxazol-3-amine Traditional Name: (5-methylisoxazol-3-yl)-[2-(1-phenyltetrazol-5-yl)-2-adamantyl]amine Formula: C21H24N6O MolecularWeight: 376.45486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2(C3CC4CC(C3)CC2C4)C5=NN=NN5C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=NO1)NC2(C3CC4CC(C3)CC2C4)C5=NN=NN5C6=CC=CC=C6

InChI

InChI=1S/C21H24N6O/c1-13-7-19(24-28-13)22-21(16-9-14-8-15(11-16)12-17(21)10-14)20-23-25-26-27(20)18-5-3-2-4-6-18/h2-7,14-17H,8-12H2,1H3,(H,22,24)