2-[3-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl ethanoate

Systemtic Name: 2-[3-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl ethanoate Openeye Name: 2-[3-(2-amino-2-oxo-ethyl)-4-methyl-thiazol-3-ium-5-yl]ethyl acetate CAS Name: acetic acid 2-[3-(2-amino-2-oxoethyl)-4-methyl-5-thiazol-3-iumyl]ethyl ester IUPAC Name: 2-[3-(2-amino-2-oxoethyl)-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl acetate Traditional Name: acetic acid 2-[3-(2-amino-2-keto-ethyl)-4-methyl-thiazol-3-ium-5-yl]ethyl ester Formula: C10H15N2O3S+ MolecularWeight: 243.3027

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)N)CCOC(=O)C

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)N)CCOC(=O)C

InChI

InChI=1S/C10H14N2O3S/c1-7-9(3-4-15-8(2)13)16-6-12(7)5-10(11)14/h6H,3-5H2,1-2H3,(H-,11,14)/p+1