1,8-bis[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]anthracene-9,10-dione

Systemtic Name: 1,8-bis[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]anthracene-9,10-dione Openeye Name: 1,8-bis[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]anthracene-9,10-dione CAS Name: 1,8-bis[(6-ethoxy-1,3-benzothiazol-2-yl)thio]anthracene-9,10-dione IUPAC Name: 1,8-bis[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]anthracene-9,10-dione Traditional Name: 1,8-bis[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-9,10-anthraquinone Formula: C32H22N2O4S4 MolecularWeight: 626.78808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SC3=CC=CC4=C3C(=O)C5=C(C4=O)C=CC=C5SC6=NC7=C(S6)C=C(C=C7)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SC3=CC=CC4=C3C(=O)C5=C(C4=O)C=CC=C5SC6=NC7=C(S6)C=C(C=C7)OCC

InChI

InChI=1S/C32H22N2O4S4/c1-3-37-17-11-13-21-25(15-17)41-31(33-21)39-23-9-5-7-19-27(23)30(36)28-20(29(19)35)8-6-10-24(28)40-32-34-22-14-12-18(38-4-2)16-26(22)42-32/h5-16H,3-4H2,1-2H3