2-(butylamino)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-(butylamino)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-(butylamino)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(butylamino)-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-(butylamino)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(butylamino)-4-methyl-thiazole-5-carboxylate Formula: C9H13N2O2S- MolecularWeight: 213.27672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=C(S1)C(=O)[O-])C

Isomeric SMILES

CCCCNC1=NC(=C(S1)C(=O)[O-])C

InChI

InChI=1S/C9H14N2O2S/c1-3-4-5-10-9-11-6(2)7(14-9)8(12)13/h3-5H2,1-2H3,(H,10,11)(H,12,13)/p-1