dimethyl 5-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CSC3=C2CCCC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CSC3=C2CCCC3)C(=O)OC

InChI

InChI=1S/C19H19NO5S/c1-24-18(22)11-7-12(19(23)25-2)9-13(8-11)20-17(21)15-10-26-16-6-4-3-5-14(15)16/h7-10H,3-6H2,1-2H3,(H,20,21)