2-[4-(carbamothioylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(carbamothioylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(carbamothioylamino)phenyl]acetic acid CAS Name: 2-[4-(carbamothioylamino)phenyl]acetic acid IUPAC Name: 2-[4-(carbamothioylamino)phenyl]acetic acid Traditional Name: 2-(4-thioureidophenyl)acetic acid Formula: C9H10N2O2S MolecularWeight: 210.2529

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)NC(=S)N

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)NC(=S)N

InChI

InChI=1S/C9H10N2O2S/c10-9(14)11-7-3-1-6(2-4-7)5-8(12)13/h1-4H,5H2,(H,12,13)(H3,10,11,14)