(2-acetamido-1,3-thiazol-4-yl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]benzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 2-[(2-thiazolin-2-ylthio)methyl]benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C17H17N3O3S3 MolecularWeight: 407.53018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC=C2CSC3=NCCS3

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC=C2CSC3=NCCS3

InChI

InChI=1S/C17H17N3O3S3/c1-11(21)19-16-20-13(10-25-16)8-23-15(22)14-5-3-2-4-12(14)9-26-17-18-6-7-24-17/h2-5,10H,6-9H2,1H3,(H,19,20,21)