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

Systemtic Name: 5-[(E)-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoyl]-6-oxidanyl-1,3-thiazine-2,4-dione Openeye Name: 5-[(E)-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoyl]-6-hydroxy-1,3-thiazine-2,4-dione CAS Name: 5-[(E)-3-(1-ethyl-3,5-dimethyl-4-pyrazolyl)-1-oxoprop-2-enyl]-6-hydroxy-1,3-thiazine-2,4-dione IUPAC Name: 5-[(E)-3-(1-ethyl-3,5-dimethylpyrazol-4-yl)prop-2-enoyl]-6-hydroxy-1,3-thiazine-2,4-dione Traditional Name: 5-[(E)-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)acryloyl]-6-hydroxy-1,3-thiazine-2,4-quinone Formula: C14H15N3O4S MolecularWeight: 321.3516

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4S/c1-4-17-8(3)9(7(2)16-17)5-6-10(18)11-12(19)15-14(21)22-13(11)20/h5-6,20H,4H2,1-3H3,(H,15,19,21)/b6-5+