(2S)-2-[6-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoic acid

Systemtic Name: (2S)-2-[6-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoic acid Openeye Name: (2S)-2-[6-(2-methylthiazol-4-yl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid CAS Name: (2S)-2-[6-(2-methyl-4-thiazolyl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid IUPAC Name: (2S)-2-[6-(2-methyl-1,3-thiazol-4-yl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid Traditional Name: (2S)-2-[3-keto-6-(2-methylthiazol-4-yl)-1,4-benzoxazin-4-yl]propionic acid Formula: C15H14N2O4S MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC3=C(C=C2)OCC(=O)N3C(C)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)C2=CC3=C(C=C2)OCC(=O)N3[C@@H](C)C(=O)O

InChI

InChI=1S/C15H14N2O4S/c1-8(15(19)20)17-12-5-10(11-7-22-9(2)16-11)3-4-13(12)21-6-14(17)18/h3-5,7-8H,6H2,1-2H3,(H,19,20)/t8-/m0/s1