tert-butyl N-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-N-[(Z)-C-methylsulfanyl-N-nitro-carbonimidoyl]carbamate

Systemtic Name: tert-butyl N-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-N-[(Z)-C-methylsulfanyl-N-nitro-carbonimidoyl]carbamate Openeye Name: tert-butyl N-[(2-chlorothiazol-5-yl)methyl]-N-[(Z)-C-methylsulfanyl-N-nitro-carbonimidoyl]carbamate CAS Name: N-[(2-chloro-5-thiazolyl)methyl]-N-[(Z)-(methylthio)-nitroiminomethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2-chloro-1,3-thiazol-5-yl)methyl]-N-[(Z)-C-methylsulfanyl-N-nitrocarbonimidoyl]carbamate Traditional Name: N-[(2-chlorothiazol-5-yl)methyl]-N-[(Z)-C-(methylthio)-N-nitro-carbonimidoyl]carbamic acid tert-butyl ester Formula: C11H15ClN4O4S2 MolecularWeight: 366.8442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CN=C(S1)Cl)C(=N[N+](=O)[O-])SC

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CN=C(S1)Cl)/C(=N/[N+](=O)[O-])/SC

InChI

InChI=1S/C11H15ClN4O4S2/c1-11(2,3)20-10(17)15(9(21-4)14-16(18)19)6-7-5-13-8(12)22-7/h5H,6H2,1-4H3/b14-9-