dimethyl 3-[(2-acetamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyloxymethyl]-5-azanyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-[(2-acetamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyloxymethyl]-5-azanyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-[(2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)oxymethyl]-5-amino-thiophene-2,4-dicarboxylate CAS Name: 3-[[(2-acetamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-oxomethoxy]methyl]-5-aminothiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[(2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)oxymethyl]-5-aminothiophene-2,4-dicarboxylate Traditional Name: 3-[(2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)oxymethyl]-5-amino-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H22N2O7S2 MolecularWeight: 466.52788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C20H22N2O7S2/c1-9(23)22-17-14(10-6-4-5-7-12(10)30-17)19(25)29-8-11-13(18(24)27-2)16(21)31-15(11)20(26)28-3/h4-8,21H2,1-3H3,(H,22,23)