methyl 3-[2-[2-(2-phenoxyethanoylamino)phenyl]sulfanylethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[2-(2-phenoxyethanoylamino)phenyl]sulfanylethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[2-[(2-phenoxyacetyl)amino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-[[2-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]ethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[2-[(2-phenoxyacetyl)amino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[[2-[(2-phenoxyacetyl)amino]phenyl]thio]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C22H20N2O5S2 MolecularWeight: 456.5346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CSC2=CC=CC=C2NC(=O)COC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CSC2=CC=CC=C2NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C22H20N2O5S2/c1-28-22(27)21-17(11-12-30-21)24-20(26)14-31-18-10-6-5-9-16(18)23-19(25)13-29-15-7-3-2-4-8-15/h2-12H,13-14H2,1H3,(H,23,25)(H,24,26)