(E)-2-diazonio-1-[3-[(2-methylpropan-2-yl)oxycarbonyl]-2-pyridin-3-yl-1,3-thiazolidin-4-yl]ethenolate

Systemtic Name: (E)-2-diazonio-1-[3-[(2-methylpropan-2-yl)oxycarbonyl]-2-pyridin-3-yl-1,3-thiazolidin-4-yl]ethenolate Openeye Name: (E)-1-[3-tert-butoxycarbonyl-2-(3-pyridyl)thiazolidin-4-yl]-2-diazonio-ethenolate CAS Name: (E)-2-diazonio-1-[3-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-(3-pyridinyl)-4-thiazolidinyl]ethenolate IUPAC Name: (E)-2-diazonio-1-[3-[(2-methylpropan-2-yl)oxycarbonyl]-2-pyridin-3-yl-1,3-thiazolidin-4-yl]ethenolate Traditional Name: (E)-1-[3-tert-butoxycarbonyl-2-(3-pyridyl)thiazolidin-4-yl]-2-diazonio-ethenolate Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CSC1C2=CN=CC=C2)C(=C[N+]#N)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C(CSC1C2=CN=CC=C2)/C(=C\[N+]#N)/[O-]

InChI

InChI=1S/C15H18N4O3S/c1-15(2,3)22-14(21)19-11(12(20)8-18-16)9-23-13(19)10-5-4-6-17-7-10/h4-8,11,13H,9H2,1-3H3/b12-8+