2-(octylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: 2-(octylamino)-1,3-thiazole-4-carboxylate Openeye Name: 2-(octylamino)thiazole-4-carboxylate CAS Name: 2-(octylamino)-4-thiazolecarboxylate IUPAC Name: 2-(octylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(octylamino)thiazole-4-carboxylate Formula: C12H19N2O2S- MolecularWeight: 255.35646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC(=CS1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCNC1=NC(=CS1)C(=O)[O-]

InChI

InChI=1S/C12H20N2O2S/c1-2-3-4-5-6-7-8-13-12-14-10(9-17-12)11(15)16/h9H,2-8H2,1H3,(H,13,14)(H,15,16)/p-1