tert-butyl 4-[(6Z)-6-[azanyl(nitroso)methylidene]-1H-pyrimidin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(6Z)-6-[azanyl(nitroso)methylidene]-1H-pyrimidin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(6Z)-6-[amino(nitroso)methylene]-1H-pyrimidin-2-yl]piperazine-1-carboxylate CAS Name: 4-[(6Z)-6-[amino(nitroso)methylidene]-1H-pyrimidin-2-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6Z)-6-[amino(nitroso)methylidene]-1H-pyrimidin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[(6Z)-6-[amino(nitroso)methylene]-1H-pyrimidin-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C14H22N6O3 MolecularWeight: 322.36288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=CC(=C(N)N=O)N2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=C/C(=C(\N)/N=O)/N2

InChI

InChI=1S/C14H22N6O3/c1-14(2,3)23-13(21)20-8-6-19(7-9-20)12-16-5-4-10(17-12)11(15)18-22/h4-5H,6-9,15H2,1-3H3,(H,16,17)/b11-10-