[2-[1-(furan-2-yl)ethylamino]-2-oxidanylidene-ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: [2-[1-(furan-2-yl)ethylamino]-2-oxidanylidene-ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: [2-[1-(2-furyl)ethylamino]-2-oxo-ethyl] 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid [2-[1-(2-furanyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(furan-2-yl)ethylamino]-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid [2-[1-(2-furyl)ethylamino]-2-keto-ethyl] ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)NC(=O)COC(=O)C2=C(SC3=C2CCCC3)NC(=O)C

Isomeric SMILES

CC(C1=CC=CO1)NC(=O)COC(=O)C2=C(SC3=C2CCCC3)NC(=O)C

InChI

InChI=1S/C19H22N2O5S/c1-11(14-7-5-9-25-14)20-16(23)10-26-19(24)17-13-6-3-4-8-15(13)27-18(17)21-12(2)22/h5,7,9,11H,3-4,6,8,10H2,1-2H3,(H,20,23)(H,21,22)