ethyl N-[[3-azanyl-6-chloranyl-5-(cyclopropylamino)pyrazin-2-yl]carbonyliminomethylamino]carbamate

Systemtic Name: ethyl N-[[3-azanyl-6-chloranyl-5-(cyclopropylamino)pyrazin-2-yl]carbonyliminomethylamino]carbamate Openeye Name: ethyl N-[[3-amino-6-chloro-5-(cyclopropylamino)pyrazine-2-carbonyl]iminomethylamino]carbamate CAS Name: N-[[[3-amino-6-chloro-5-(cyclopropylamino)-2-pyrazinyl]-oxomethyl]iminomethylamino]carbamic acid ethyl ester IUPAC Name: ethyl N-[[3-amino-6-chloro-5-(cyclopropylamino)pyrazine-2-carbonyl]iminomethylamino]carbamate Traditional Name: N-[[3-amino-6-chloro-5-(cyclopropylamino)pyrazinoyl]iminomethylamino]carbamic acid ethyl ester Formula: C12H16ClN7O3 MolecularWeight: 341.75354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NNC=NC(=O)C1=C(N=C(C(=N1)Cl)NC2CC2)N

Isomeric SMILES

CCOC(=O)NNC=NC(=O)C1=C(N=C(C(=N1)Cl)NC2CC2)N

InChI

InChI=1S/C12H16ClN7O3/c1-2-23-12(22)20-16-5-15-11(21)7-9(14)19-10(8(13)18-7)17-6-3-4-6/h5-6H,2-4H2,1H3,(H,20,22)(H3,14,17,19)(H,15,16,21)