ethyl N-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-N-(N'-methyl-N-nitro-carbamimidoyl)carbamate

Systemtic Name: ethyl N-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-N-(N'-methyl-N-nitro-carbamimidoyl)carbamate Openeye Name: ethyl N-[(2-chlorothiazol-5-yl)methyl]-N-(N'-methyl-N-nitro-carbamimidoyl)carbamate CAS Name: N-[(2-chloro-5-thiazolyl)methyl]-N-[methylimino(nitramido)methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(2-chloro-1,3-thiazol-5-yl)methyl]-N-(N'-methyl-N-nitrocarbamimidoyl)carbamate Traditional Name: N-[(2-chlorothiazol-5-yl)methyl]-N-(N'-methyl-N-nitro-amidino)carbamic acid ethyl ester Formula: C9H12ClN5O4S MolecularWeight: 321.74068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CC1=CN=C(S1)Cl)C(=NC)N[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N(CC1=CN=C(S1)Cl)C(=NC)N[N+](=O)[O-]

InChI

InChI=1S/C9H12ClN5O4S/c1-3-19-9(16)14(8(11-2)13-15(17)18)5-6-4-12-7(10)20-6/h4H,3,5H2,1-2H3,(H,11,13)