1-(3,5-dimethylpyrazol-1-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(3,5-dimethylpyrazol-1-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(3,5-dimethylpyrazol-1-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanone CAS Name: 1-(3,5-dimethyl-1-pyrazolyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]ethanone IUPAC Name: 1-(3,5-dimethylpyrazol-1-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(3,5-dimethylpyrazol-1-yl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]ethanone Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3C(=CC(=N3)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3C(=CC(=N3)C)C

InChI

InChI=1S/C16H17N3O2S2/c1-4-21-12-5-6-13-14(8-12)23-16(17-13)22-9-15(20)19-11(3)7-10(2)18-19/h5-8H,4,9H2,1-3H3