3-[2-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[2-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one Openeye Name: 3-[2-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-2-oxo-ethyl]-1,3-benzothiazol-2-one CAS Name: 3-[2-[2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[2-[2-(3-chloro-2,6-dimethoxybenzoyl)pyrazolidin-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one Traditional Name: 3-[2-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]-2-keto-ethyl]-1,3-benzothiazol-2-one Formula: C21H20ClN3O5S MolecularWeight: 461.9186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CN3C4=CC=CC=C4SC3=O

Isomeric SMILES

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C21H20ClN3O5S/c1-29-15-9-8-13(22)19(30-2)18(15)20(27)25-11-5-10-24(25)17(26)12-23-14-6-3-4-7-16(14)31-21(23)28/h3-4,6-9H,5,10-12H2,1-2H3