methyl 2-[2-[4-(thiophen-2-ylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: methyl 2-[2-[4-(thiophen-2-ylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate Openeye Name: methyl 2-[2-[4-(thiophene-2-carbonylamino)phenyl]sulfanylpropanoylamino]benzoate CAS Name: 2-[[1-oxo-2-[[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]thio]propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[4-(thiophene-2-carbonylamino)phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 2-[2-[[4-(2-thenoylamino)phenyl]thio]propanoylamino]benzoic acid methyl ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H20N2O4S2/c1-14(20(25)24-18-7-4-3-6-17(18)22(27)28-2)30-16-11-9-15(10-12-16)23-21(26)19-8-5-13-29-19/h3-14H,1-2H3,(H,23,26)(H,24,25)