N-[5-[3-(3-chloranyl-4-cyano-phenyl)-5,5-dimethyl-4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-1,3-benzothiazol-2-yl]ethanamide

Systemtic Name: N-[5-[3-(3-chloranyl-4-cyano-phenyl)-5,5-dimethyl-4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-1,3-benzothiazol-2-yl]ethanamide Openeye Name: N-[5-[3-(3-chloro-4-cyano-phenyl)-5,5-dimethyl-4-oxo-2-thioxo-imidazolidin-1-yl]-1,3-benzothiazol-2-yl]acetamide CAS Name: N-[5-[3-(3-chloro-4-cyanophenyl)-5,5-dimethyl-4-oxo-2-sulfanylidene-1-imidazolidinyl]-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-[5-[3-(3-chloro-4-cyanophenyl)-5,5-dimethyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]-1,3-benzothiazol-2-yl]acetamide Traditional Name: N-[5-[3-(3-chloro-4-cyano-phenyl)-4-keto-5,5-dimethyl-2-thioxo-imidazolidin-1-yl]-1,3-benzothiazol-2-yl]acetamide Formula: C21H16ClN5O2S2 MolecularWeight: 469.96704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=CC(=C2)N3C(=S)N(C(=O)C3(C)C)C4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=CC(=C2)N3C(=S)N(C(=O)C3(C)C)C4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C21H16ClN5O2S2/c1-11(28)24-19-25-16-9-14(6-7-17(16)31-19)27-20(30)26(18(29)21(27,2)3)13-5-4-12(10-23)15(22)8-13/h4-9H,1-3H3,(H,24,25,28)