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

Systemtic Name: 5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-phenyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-phenyl-oxazole-4-carbonitrile CAS Name: 5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]-1-piperazin-4-iumyl]-2-phenyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-phenyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-[(4-methylfurazan-3-yl)methyl]piperazin-4-ium-1-yl]-2-phenyl-oxazole-4-carbonitrile Formula: C18H19N6O2+ MolecularWeight: 351.38246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NON=C1C[NH+]2CCN(CC2)C3=C(N=C(O3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=NON=C1C[NH+]2CCN(CC2)C3=C(N=C(O3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C18H18N6O2/c1-13-16(22-26-21-13)12-23-7-9-24(10-8-23)18-15(11-19)20-17(25-18)14-5-3-2-4-6-14/h2-6H,7-10,12H2,1H3/p+1