(2-ethyl-1,3-thiazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (2-ethyl-1,3-thiazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-ethylthiazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(2-methoxyethylamino)-2-oxoethyl]thio]benzoic acid (2-ethyl-4-thiazolyl)methyl ester IUPAC Name: (2-ethyl-1,3-thiazol-4-yl)methyl 2-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(2-methoxyethylamino)ethyl]thio]benzoic acid (2-ethylthiazol-4-yl)methyl ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)COC(=O)C2=CC=CC=C2SCC(=O)NCCOC

Isomeric SMILES

CCC1=NC(=CS1)COC(=O)C2=CC=CC=C2SCC(=O)NCCOC

InChI

InChI=1S/C18H22N2O4S2/c1-3-17-20-13(11-26-17)10-24-18(22)14-6-4-5-7-15(14)25-12-16(21)19-8-9-23-2/h4-7,11H,3,8-10,12H2,1-2H3,(H,19,21)