3,5-bis(azanyl)-N-tert-butyl-6-chloranyl-N-(3-oxidanylidenebutanoyl)pyrazine-2-carboxamide

Systemtic Name: 3,5-bis(azanyl)-N-tert-butyl-6-chloranyl-N-(3-oxidanylidenebutanoyl)pyrazine-2-carboxamide Openeye Name: 3,5-diamino-N-tert-butyl-6-chloro-N-(3-oxobutanoyl)pyrazine-2-carboxamide CAS Name: 3,5-diamino-N-tert-butyl-6-chloro-N-(1,3-dioxobutyl)-2-pyrazinecarboxamide IUPAC Name: 3,5-diamino-N-tert-butyl-6-chloro-N-(3-oxobutanoyl)pyrazine-2-carboxamide Traditional Name: N-acetoacetyl-3,5-diamino-N-tert-butyl-6-chloro-pyrazinamide Formula: C13H18ClN5O3 MolecularWeight: 327.76672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)N(C(=O)C1=C(N=C(C(=N1)Cl)N)N)C(C)(C)C

Isomeric SMILES

CC(=O)CC(=O)N(C(=O)C1=C(N=C(C(=N1)Cl)N)N)C(C)(C)C

InChI

InChI=1S/C13H18ClN5O3/c1-6(20)5-7(21)19(13(2,3)4)12(22)8-10(15)18-11(16)9(14)17-8/h5H2,1-4H3,(H4,15,16,18)