3-(phenylcarbonylcarbamoylamino)-4-phenylsulfanyl-benzoic acid

Systemtic Name: 3-(phenylcarbonylcarbamoylamino)-4-phenylsulfanyl-benzoic acid Openeye Name: 3-(benzoylcarbamoylamino)-4-phenylsulfanyl-benzoic acid CAS Name: 3-[[benzamido(oxo)methyl]amino]-4-(phenylthio)benzoic acid IUPAC Name: 3-(benzoylcarbamoylamino)-4-phenylsulfanylbenzoic acid Traditional Name: 3-(benzoylcarbamoylamino)-4-(phenylthio)benzoic acid Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=O)NC2=C(C=CC(=C2)C(=O)O)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=O)NC2=C(C=CC(=C2)C(=O)O)SC3=CC=CC=C3

InChI

InChI=1S/C21H16N2O4S/c24-19(14-7-3-1-4-8-14)23-21(27)22-17-13-15(20(25)26)11-12-18(17)28-16-9-5-2-6-10-16/h1-13H,(H,25,26)(H2,22,23,24,27)