2-tert-butyl-5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-tert-butyl-5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-tert-butyl-5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-4-ium-1-yl]oxazole-4-carbonitrile CAS Name: 2-tert-butyl-5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]-1-piperazin-4-iumyl]-4-oxazolecarbonitrile IUPAC Name: 2-tert-butyl-5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-4-ium-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-tert-butyl-5-[4-[(4-methylfurazan-3-yl)methyl]piperazin-4-ium-1-yl]oxazole-4-carbonitrile Formula: C16H23N6O2+ MolecularWeight: 331.39282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NON=C1C[NH+]2CCN(CC2)C3=C(N=C(O3)C(C)(C)C)C#N

Isomeric SMILES

CC1=NON=C1C[NH+]2CCN(CC2)C3=C(N=C(O3)C(C)(C)C)C#N

InChI

InChI=1S/C16H22N6O2/c1-11-13(20-24-19-11)10-21-5-7-22(8-6-21)14-12(9-17)18-15(23-14)16(2,3)4/h5-8,10H2,1-4H3/p+1