phenyl (1Z)-4-[[(3-azanylpyrazin-2-yl)carbonylamino]methyl]-N-isocyano-4-phenyl-piperidine-1-carboximidate

Systemtic Name: phenyl (1Z)-4-[[(3-azanylpyrazin-2-yl)carbonylamino]methyl]-N-isocyano-4-phenyl-piperidine-1-carboximidate Openeye Name: phenyl (1Z)-4-[[(3-aminopyrazine-2-carbonyl)amino]methyl]-N-isocyano-4-phenyl-piperidine-1-carboximidate CAS Name: (1Z)-4-[[[(3-amino-2-pyrazinyl)-oxomethyl]amino]methyl]-N-isocyano-4-phenyl-1-piperidinecarboximidic acid phenyl ester IUPAC Name: phenyl (1Z)-4-[[(3-aminopyrazine-2-carbonyl)amino]methyl]-N-isocyano-4-phenylpiperidine-1-carboximidate Traditional Name: (1Z)-4-[[(3-aminopyrazinoyl)amino]methyl]-N-isocyano-4-phenyl-piperidine-1-carboximidic acid phenyl ester Formula: C25H25N7O2 MolecularWeight: 455.5117

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]N=C(N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

[C-]#[N+]/N=C(/N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3)\OC4=CC=CC=C4

InChI

InChI=1S/C25H25N7O2/c1-27-31-24(34-20-10-6-3-7-11-20)32-16-12-25(13-17-32,19-8-4-2-5-9-19)18-30-23(33)21-22(26)29-15-14-28-21/h2-11,14-15H,12-13,16-18H2,(H2,26,29)(H,30,33)/b31-24-