(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=C(SC3=C2CCCC3)NC(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=C(SC3=C2CCCC3)NC(=O)C

InChI

InChI=1S/C17H20N2O4S/c1-9-13(10(2)23-19-9)8-22-17(21)15-12-6-4-5-7-14(12)24-16(15)18-11(3)20/h4-8H2,1-3H3,(H,18,20)