3-heptoxy-5-(2-oxidanylpropylcarbamoylamino)-1,2-thiazole-4-carboxylic acid

Systemtic Name: 3-heptoxy-5-(2-oxidanylpropylcarbamoylamino)-1,2-thiazole-4-carboxylic acid Openeye Name: 3-heptoxy-5-(2-hydroxypropylcarbamoylamino)isothiazole-4-carboxylic acid CAS Name: 3-heptoxy-5-[[(2-hydroxypropylamino)-oxomethyl]amino]-4-isothiazolecarboxylic acid IUPAC Name: 3-heptoxy-5-(2-hydroxypropylcarbamoylamino)-1,2-thiazole-4-carboxylic acid Traditional Name: 3-heptoxy-5-(2-hydroxypropylcarbamoylamino)isothiazole-4-carboxylic acid Formula: C15H25N3O5S MolecularWeight: 359.4411

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=NSC(=C1C(=O)O)NC(=O)NCC(C)O

Isomeric SMILES

CCCCCCCOC1=NSC(=C1C(=O)O)NC(=O)NCC(C)O

InChI

InChI=1S/C15H25N3O5S/c1-3-4-5-6-7-8-23-12-11(14(20)21)13(24-18-12)17-15(22)16-9-10(2)19/h10,19H,3-9H2,1-2H3,(H,20,21)(H2,16,17,22)