methyl 3-methyl-2-octylsulfanyl-imidazole-4-carboxylate

Systemtic Name: methyl 3-methyl-2-octylsulfanyl-imidazole-4-carboxylate Openeye Name: methyl 3-methyl-2-octylsulfanyl-imidazole-4-carboxylate CAS Name: 3-methyl-2-(octylthio)-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-2-octylsulfanylimidazole-4-carboxylate Traditional Name: 3-methyl-2-(octylthio)imidazole-4-carboxylic acid methyl ester Formula: C14H24N2O2S MolecularWeight: 284.41756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC=C(N1C)C(=O)OC

Isomeric SMILES

CCCCCCCCSC1=NC=C(N1C)C(=O)OC

InChI

InChI=1S/C14H24N2O2S/c1-4-5-6-7-8-9-10-19-14-15-11-12(16(14)2)13(17)18-3/h11H,4-10H2,1-3H3