[2-[(3-fluorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 2-acetamido-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: [2-[(3-fluorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 2-acetamido-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: [2-[(3-fluorophenyl)methyl-methyl-amino]-2-oxo-ethyl] 2-acetamido-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-acetamido-4-thiophen-2-yl-3-thiophenecarboxylic acid [2-[(3-fluorophenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3-fluorophenyl)methyl-methylamino]-2-oxoethyl] 2-acetamido-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-acetamido-4-(2-thienyl)thiophene-3-carboxylic acid [2-[(3-fluorobenzyl)-methyl-amino]-2-keto-ethyl] ester Formula: C21H19FN2O4S2 MolecularWeight: 446.514963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=CS1)C2=CC=CS2)C(=O)OCC(=O)N(C)CC3=CC(=CC=C3)F

Isomeric SMILES

CC(=O)NC1=C(C(=CS1)C2=CC=CS2)C(=O)OCC(=O)N(C)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H19FN2O4S2/c1-13(25)23-20-19(16(12-30-20)17-7-4-8-29-17)21(27)28-11-18(26)24(2)10-14-5-3-6-15(22)9-14/h3-9,12H,10-11H2,1-2H3,(H,23,25)