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

Systemtic Name: phenyl N-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-N-(N'-methyl-N-nitro-carbamimidoyl)carbamate Openeye Name: phenyl 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 phenyl ester IUPAC Name: phenyl 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 phenyl ester Formula: C13H12ClN5O4S MolecularWeight: 369.78348

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N[N+](=O)[O-])N(CC1=CN=C(S1)Cl)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CN=C(N[N+](=O)[O-])N(CC1=CN=C(S1)Cl)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C13H12ClN5O4S/c1-15-12(17-19(21)22)18(8-10-7-16-11(14)24-10)13(20)23-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,15,17)