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

Systemtic Name: ethyl N-[[3-azanyl-6-chloranyl-5-(prop-2-enylamino)pyrazin-2-yl]carbonyliminomethylamino]carbamate Openeye Name: ethyl N-[[5-(allylamino)-3-amino-6-chloro-pyrazine-2-carbonyl]iminomethylamino]carbamate CAS Name: N-[[[3-amino-6-chloro-5-(prop-2-enylamino)-2-pyrazinyl]-oxomethyl]iminomethylamino]carbamic acid ethyl ester IUPAC Name: ethyl N-[[3-amino-6-chloro-5-(prop-2-enylamino)pyrazine-2-carbonyl]iminomethylamino]carbamate Traditional Name: N-[[5-(allylamino)-3-amino-6-chloro-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)NCC=C)N

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClN7O3/c1-3-5-15-10-8(13)18-7(9(14)19-10)11(21)16-6-17-20-12(22)23-4-2/h3,6H,1,4-5H2,2H3,(H,20,22)(H3,14,15,19)(H,16,17,21)