2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C14H13N3O4S MolecularWeight: 319.33572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C

Isomeric SMILES

CC1=CC(=NN1C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C

InChI

InChI=1S/C14H13N3O4S/c1-9-7-10(2)17(15-9)13(18)8-16-14(19)11-5-3-4-6-12(11)22(16,20)21/h3-7H,8H2,1-2H3