2,4-bis(1,3-benzothiazol-2-yl)-1,3,5-triphenyl-pentane-1,5-dione

Systemtic Name: 2,4-bis(1,3-benzothiazol-2-yl)-1,3,5-triphenyl-pentane-1,5-dione Openeye Name: 2,4-bis(1,3-benzothiazol-2-yl)-1,3,5-triphenyl-pentane-1,5-dione CAS Name: 2,4-bis(1,3-benzothiazol-2-yl)-1,3,5-triphenylpentane-1,5-dione IUPAC Name: 2,4-bis(1,3-benzothiazol-2-yl)-1,3,5-triphenylpentane-1,5-dione Traditional Name: 2,4-bis(1,3-benzothiazol-2-yl)-1,3,5-triphenyl-pentane-1,5-dione Formula: C37H26N2O2S2 MolecularWeight: 594.74454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4)C(C5=NC6=CC=CC=C6S5)C(=O)C7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)C(C(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4)C(C5=NC6=CC=CC=C6S5)C(=O)C7=CC=CC=C7

InChI

InChI=1S/C37H26N2O2S2/c40-34(25-16-6-2-7-17-25)32(36-38-27-20-10-12-22-29(27)42-36)31(24-14-4-1-5-15-24)33(35(41)26-18-8-3-9-19-26)37-39-28-21-11-13-23-30(28)43-37/h1-23,31-33H