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

Systemtic Name: 5-(dimethylcarbamoylamino)-3-heptoxy-1,2-thiazole-4-carboxylic acid Openeye Name: 5-(dimethylcarbamoylamino)-3-heptoxy-isothiazole-4-carboxylic acid CAS Name: 5-[[dimethylamino(oxo)methyl]amino]-3-heptoxy-4-isothiazolecarboxylic acid IUPAC Name: 5-(dimethylcarbamoylamino)-3-heptoxy-1,2-thiazole-4-carboxylic acid Traditional Name: 5-(dimethylcarbamoylamino)-3-heptoxy-isothiazole-4-carboxylic acid Formula: C14H23N3O4S MolecularWeight: 329.41512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O4S/c1-4-5-6-7-8-9-21-11-10(13(18)19)12(22-16-11)15-14(20)17(2)3/h4-9H2,1-3H3,(H,15,20)(H,18,19)