3-[carbamothioyl-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)amino]propanoic acid

Systemtic Name: 3-[carbamothioyl-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)amino]propanoic acid Openeye Name: 3-[carbamothioyl-(2-oxo-3H-1,3-benzoxazol-6-yl)amino]propanoic acid CAS Name: 3-[carbamothioyl-(2-oxo-3H-1,3-benzoxazol-6-yl)amino]propanoic acid IUPAC Name: 3-[carbamothioyl-(2-oxo-3H-1,3-benzoxazol-6-yl)amino]propanoic acid Traditional Name: 3-[(2-keto-3H-1,3-benzoxazol-6-yl)-thiocarbamoyl-amino]propionic acid Formula: C11H11N3O4S MolecularWeight: 281.28774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N(CCC(=O)O)C(=S)N)OC(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1N(CCC(=O)O)C(=S)N)OC(=O)N2

InChI

InChI=1S/C11H11N3O4S/c12-10(19)14(4-3-9(15)16)6-1-2-7-8(5-6)18-11(17)13-7/h1-2,5H,3-4H2,(H2,12,19)(H,13,17)(H,15,16)