2-[[4-(phenylcarbamothioylamino)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(phenylcarbamothioylamino)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(phenylcarbamothioylamino)benzoyl]amino]acetic acid CAS Name: 2-[[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-(phenylcarbamothioylamino)benzoyl]amino]acetic acid Traditional Name: 2-[[4-(phenylthiocarbamoylamino)benzoyl]amino]acetic acid Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)NCC(=O)O

InChI

InChI=1S/C16H15N3O3S/c20-14(21)10-17-15(22)11-6-8-13(9-7-11)19-16(23)18-12-4-2-1-3-5-12/h1-9H,10H2,(H,17,22)(H,20,21)(H2,18,19,23)