4-methyl-2-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl]-1,3-thiazole-5-carboxylate

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl]-1,3-thiazole-5-carboxylate Openeye Name: 4-methyl-2-[2-oxo-2-(3-pyridylmethylamino)ethyl]thiazole-5-carboxylate CAS Name: 4-methyl-2-[2-oxo-2-(3-pyridinylmethylamino)ethyl]-5-thiazolecarboxylate IUPAC Name: 4-methyl-2-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-keto-2-(3-pyridylmethylamino)ethyl]-4-methyl-thiazole-5-carboxylate Formula: C13H12N3O3S- MolecularWeight: 290.31768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC(=O)NCC2=CN=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)CC(=O)NCC2=CN=CC=C2)C(=O)[O-]

InChI

InChI=1S/C13H13N3O3S/c1-8-12(13(18)19)20-11(16-8)5-10(17)15-7-9-3-2-4-14-6-9/h2-4,6H,5,7H2,1H3,(H,15,17)(H,18,19)/p-1