(2-acetamido-1,3-thiazol-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C17H15N3O3S3 MolecularWeight: 405.5143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC=C2SCC3=CSC=N3

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC=C2SCC3=CSC=N3

InChI

InChI=1S/C17H15N3O3S3/c1-11(21)19-17-20-12(8-26-17)6-23-16(22)14-4-2-3-5-15(14)25-9-13-7-24-10-18-13/h2-5,7-8,10H,6,9H2,1H3,(H,19,20,21)