O-methyl N-[2-(5-nitro-2-propyl-imidazol-1-yl)ethyl]carbamothioate

Systemtic Name: O-methyl N-[2-(5-nitro-2-propyl-imidazol-1-yl)ethyl]carbamothioate Openeye Name: O-methyl N-[2-(5-nitro-2-propyl-imidazol-1-yl)ethyl]carbamothioate CAS Name: N-[2-(5-nitro-2-propyl-1-imidazolyl)ethyl]carbamothioic acid O-methyl ester IUPAC Name: O-methyl N-[2-(5-nitro-2-propylimidazol-1-yl)ethyl]carbamothioate Traditional Name: N-[2-(5-nitro-2-propyl-imidazol-1-yl)ethyl]thiocarbamic acid O-methyl ester Formula: C10H16N4O3S MolecularWeight: 272.32404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(N1CCNC(=S)OC)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NC=C(N1CCNC(=S)OC)[N+](=O)[O-]

InChI

InChI=1S/C10H16N4O3S/c1-3-4-8-12-7-9(14(15)16)13(8)6-5-11-10(18)17-2/h7H,3-6H2,1-2H3,(H,11,18)