5-methyl-2-(octan-2-ylamino)-4-oxidanylidene-thieno[2,3-d][1,3]oxazine-6-carboxylic acid

Systemtic Name: 5-methyl-2-(octan-2-ylamino)-4-oxidanylidene-thieno[2,3-d][1,3]oxazine-6-carboxylic acid Openeye Name: 5-methyl-2-(1-methylheptylamino)-4-oxo-thieno[2,3-d][1,3]oxazine-6-carboxylic acid CAS Name: 5-methyl-2-(octan-2-ylamino)-4-oxo-6-thieno[2,3-d][1,3]oxazinecarboxylic acid IUPAC Name: 5-methyl-2-(octan-2-ylamino)-4-oxothieno[2,3-d][1,3]oxazine-6-carboxylic acid Traditional Name: 4-keto-5-methyl-2-(1-methylheptylamino)thieno[2,3-d][1,3]oxazine-6-carboxylic acid Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC1=NC2=C(C(=C(S2)C(=O)O)C)C(=O)O1

Isomeric SMILES

CCCCCCC(C)NC1=NC2=C(C(=C(S2)C(=O)O)C)C(=O)O1

InChI

InChI=1S/C16H22N2O4S/c1-4-5-6-7-8-9(2)17-16-18-13-11(15(21)22-16)10(3)12(23-13)14(19)20/h9H,4-8H2,1-3H3,(H,17,18)(H,19,20)