4-[[2-(pentanoylamino)-1,3-thiazol-4-yl]carbonylamino]benzoate

Systemtic Name: 4-[[2-(pentanoylamino)-1,3-thiazol-4-yl]carbonylamino]benzoate Openeye Name: 4-[[2-(pentanoylamino)thiazole-4-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[2-(1-oxopentylamino)-4-thiazolyl]methyl]amino]benzoate IUPAC Name: 4-[[2-(pentanoylamino)-1,3-thiazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[2-(valerylamino)thiazole-4-carbonyl]amino]benzoate Formula: C16H16N3O4S- MolecularWeight: 346.38094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=NC(=CS1)C(=O)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=NC(=CS1)C(=O)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C16H17N3O4S/c1-2-3-4-13(20)19-16-18-12(9-24-16)14(21)17-11-7-5-10(6-8-11)15(22)23/h5-9H,2-4H2,1H3,(H,17,21)(H,22,23)(H,18,19,20)/p-1