methyl 3-[[2-oxidanylidene-2-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]ethanoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-oxidanylidene-2-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]ethanoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[(1-benzyl-2-hydroxy-ethyl)amino]-2-oxo-acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1,2-dioxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-2-oxoacetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[(1-benzyl-2-hydroxy-ethyl)amino]-2-keto-acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C(=O)NC(CC2=CC=CC=C2)CO

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C(=O)NC(CC2=CC=CC=C2)CO

InChI

InChI=1S/C17H18N2O5S/c1-24-17(23)14-13(7-8-25-14)19-16(22)15(21)18-12(10-20)9-11-5-3-2-4-6-11/h2-8,12,20H,9-10H2,1H3,(H,18,21)(H,19,22)