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

Systemtic Name: 3-heptoxy-5-(5-oxidanylpentylcarbamoylamino)-1,2-thiazole-4-carboxylic acid Openeye Name: 3-heptoxy-5-(5-hydroxypentylcarbamoylamino)isothiazole-4-carboxylic acid CAS Name: 3-heptoxy-5-[[(5-hydroxypentylamino)-oxomethyl]amino]-4-isothiazolecarboxylic acid IUPAC Name: 3-heptoxy-5-(5-hydroxypentylcarbamoylamino)-1,2-thiazole-4-carboxylic acid Traditional Name: 3-heptoxy-5-(5-hydroxypentylcarbamoylamino)isothiazole-4-carboxylic acid Formula: C17H29N3O5S MolecularWeight: 387.49426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=NSC(=C1C(=O)O)NC(=O)NCCCCCO

Isomeric SMILES

CCCCCCCOC1=NSC(=C1C(=O)O)NC(=O)NCCCCCO

InChI

InChI=1S/C17H29N3O5S/c1-2-3-4-5-9-12-25-14-13(16(22)23)15(26-20-14)19-17(24)18-10-7-6-8-11-21/h21H,2-12H2,1H3,(H,22,23)(H2,18,19,24)