tert-butyl 2-[[[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]carbonyliminomethylamino]carbamoylamino]ethanoate

Systemtic Name: tert-butyl 2-[[[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]carbonyliminomethylamino]carbamoylamino]ethanoate Openeye Name: tert-butyl 2-[[(3,5-diamino-6-chloro-pyrazine-2-carbonyl)iminomethylamino]carbamoylamino]acetate CAS Name: 2-[[[[(3,5-diamino-6-chloro-2-pyrazinyl)-oxomethyl]iminomethylhydrazo]-oxomethyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[(3,5-diamino-6-chloropyrazine-2-carbonyl)iminomethylamino]carbamoylamino]acetate Traditional Name: 2-[[(3,5-diamino-6-chloro-pyrazinoyl)iminomethylamino]carbamoylamino]acetic acid tert-butyl ester Formula: C13H19ClN8O4 MolecularWeight: 386.79416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNC(=O)NNC=NC(=O)C1=C(N=C(C(=N1)Cl)N)N

Isomeric SMILES

CC(C)(C)OC(=O)CNC(=O)NNC=NC(=O)C1=C(N=C(C(=N1)Cl)N)N

InChI

InChI=1S/C13H19ClN8O4/c1-13(2,3)26-6(23)4-17-12(25)22-19-5-18-11(24)7-9(15)21-10(16)8(14)20-7/h5H,4H2,1-3H3,(H4,15,16,21)(H2,17,22,25)(H,18,19,24)