6-oxidanyl-5-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]-1,3-thiazine-2,4-dione

Systemtic Name: 6-oxidanyl-5-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]-1,3-thiazine-2,4-dione Openeye Name: 6-hydroxy-5-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]-1,3-thiazine-2,4-dione CAS Name: 6-hydroxy-5-[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]-1,3-thiazine-2,4-dione IUPAC Name: 6-hydroxy-5-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]-1,3-thiazine-2,4-dione Traditional Name: 6-hydroxy-5-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]-1,3-thiazine-2,4-quinone Formula: C13H13N3O4S MolecularWeight: 307.32502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)C2=C(SC(=O)NC2=O)O

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)C2=C(SC(=O)NC2=O)O

InChI

InChI=1S/C13H13N3O4S/c1-6-8(7(2)16(3)15-6)4-5-9(17)10-11(18)14-13(20)21-12(10)19/h4-5,19H,1-3H3,(H,14,18,20)/b5-4+