methyl 2-methyl-3-[[3-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 2-methyl-3-[[3-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]benzoate Openeye Name: methyl 2-methyl-3-[[3-(thiophene-2-carbonylamino)benzoyl]amino]benzoate CAS Name: 2-methyl-3-[[oxo-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-[[3-(thiophene-2-carbonylamino)benzoyl]amino]benzoate Traditional Name: 2-methyl-3-[[3-(2-thenoylamino)benzoyl]amino]benzoic acid methyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C21H18N2O4S/c1-13-16(21(26)27-2)8-4-9-17(13)23-19(24)14-6-3-7-15(12-14)22-20(25)18-10-5-11-28-18/h3-12H,1-2H3,(H,22,25)(H,23,24)