3-[[4-(furan-2-ylcarbonylamino)phenyl]sulfanylcarbamoylamino]benzoic acid

Systemtic Name: 3-[[4-(furan-2-ylcarbonylamino)phenyl]sulfanylcarbamoylamino]benzoic acid Openeye Name: 3-[[4-(furan-2-carbonylamino)phenyl]sulfanylcarbamoylamino]benzoic acid CAS Name: 3-[[[[[4-[[2-furanyl(oxo)methyl]amino]phenyl]thio]amino]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[4-(furan-2-carbonylamino)phenyl]sulfanylcarbamoylamino]benzoic acid Traditional Name: 3-[[[4-(2-furoylamino)phenyl]thio]carbamoylamino]benzoic acid Formula: C19H15N3O5S MolecularWeight: 397.4045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NSC2=CC=C(C=C2)NC(=O)C3=CC=CO3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NSC2=CC=C(C=C2)NC(=O)C3=CC=CO3)C(=O)O

InChI

InChI=1S/C19H15N3O5S/c23-17(16-5-2-10-27-16)20-13-6-8-15(9-7-13)28-22-19(26)21-14-4-1-3-12(11-14)18(24)25/h1-11H,(H,20,23)(H,24,25)(H2,21,22,26)