2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1-yl)ethanone

Systemtic Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1-yl)ethanone Openeye Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethyl-1-quinolyl)ethanone CAS Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-1-(2,2,4,6,7-pentamethyl-1-quinolinyl)ethanone IUPAC Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1-yl)ethanone Traditional Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-1-(2,2,4,6,7-pentamethyl-1-quinolyl)ethanone Formula: C25H28N2O2S2 MolecularWeight: 452.63202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3C4=CC(=C(C=C4C(=CC3(C)C)C)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3C4=CC(=C(C=C4C(=CC3(C)C)C)C)C

InChI

InChI=1S/C25H28N2O2S2/c1-7-29-18-8-9-20-22(12-18)31-24(26-20)30-14-23(28)27-21-11-16(3)15(2)10-19(21)17(4)13-25(27,5)6/h8-13H,7,14H2,1-6H3