2-oxidanyl-4-[(phenylmethyl)carbamothioylamino]benzoic acid

Systemtic Name: 2-oxidanyl-4-[(phenylmethyl)carbamothioylamino]benzoic acid Openeye Name: 4-(benzylcarbamothioylamino)-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-4-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-(benzylcarbamothioylamino)-2-hydroxybenzoic acid Traditional Name: 4-(benzylthiocarbamoylamino)-2-hydroxy-benzoic acid Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C15H14N2O3S/c18-13-8-11(6-7-12(13)14(19)20)17-15(21)16-9-10-4-2-1-3-5-10/h1-8,18H,9H2,(H,19,20)(H2,16,17,21)