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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C=CC(=O)C2=C(SC(=O)NC2=O)O

Isomeric SMILES

CCN1C=C(C(=N1)C)/C=C/C(=O)C2=C(SC(=O)NC2=O)O

InChI

InChI=1S/C13H13N3O4S/c1-3-16-6-8(7(2)15-16)4-5-9(17)10-11(18)14-13(20)21-12(10)19/h4-6,19H,3H2,1-2H3,(H,14,18,20)/b5-4+